A0A077Z9X4_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077Z9X4, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 240 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	30.4	Very low	26.3	Very low	221 Å²	221	138.7 Å²	138.7	100%	1.089	70%	0.703	S	S	*	*				0	123	0	-69.8	-169	146.4	0	0	106.9
2	P	36.8	Very low	26.1	Very low	123 Å²	123	145.8 Å²	145.8	80%	0.799	72%	0.715	S	S	*	*				-144.5	123.1	74.6	34.1	-14.7	0	0	0	113.4
3	N	28	Very low	26.2	Very low	127 Å²	127	146.2 Å²	146.2	68%	0.679	71%	0.71	S	S	*	*			trans	-144.6	37.2	165.1	-132.8	-23.6	0	0	0	111.2	S5 H6	N3-S5 VanDerWaalsContact C-N 3.27Å; N3-H6 PolarHBondContact OD1-ND1 3.23Å
4	L	29.3	Very low	26.3	Very low	110 Å²	110	144.4 Å²	144.4	58%	0.576	71%	0.711	S	S	*	*			trans	-80.7	-6.2	175.4	-75.5	166.9	0	0	0	112.9	H6 R7	L4-H6 VanDerWaalsContact C-N 3.34Å; L4-H6 PolarHBondContact O-N 3.09Å; L4-R7 PolarHBondContact O-N 3.36Å
5	S	26.8	Very low	26.6	Very low	97 Å²	97	135.9 Å²	135.9	68%	0.678	68%	0.676	S	S	*	*	H	α-helix	trans	-64.1	-37.8	179.3	-155	0	0	0	0	112.3	N3 R7	N3-S5 VanDerWaalsContact C-N 3.27Å; S5-R7 PolarHBondContact O-N 3.25Å
6	H	25.9	Very low	27.2	Very low	132 Å²	132	128.8 Å²	128.8	61%	0.611	64%	0.643	S	S	*	*	H	α-helix	trans	-75.7	-19.8	-176.3	-75.5	89.5	0	0	0	114.6	N3 L4	N3-H6 PolarHBondContact OD1-ND1 3.23Å; L4-H6 VanDerWaalsContact C-N 3.34Å; L4-H6 PolarHBondContact O-N 3.09Å
7	R	23.9	Very low	27.4	Very low	195 Å²	195	128.6 Å²	128.6	74%	0.736	64%	0.64	S	S	*	*	H	α-helix	trans	-87.6	-23.5	-176.2	-85.3	179.7	67.3	-176.8	0.1	114.1	L4 S5 E9	L4-R7 PolarHBondContact O-N 3.36Å; S5-R7 PolarHBondContact O-N 3.25Å; R7-E9 VanDerWaalsContact C-N 3.35Å
8	V	22.2	Very low	27.4	Very low	104 Å²	104	124.3 Å²	124.3	63%	0.63	63%	0.634	S	S	*	*	H	α-helix	trans	-80	-22.7	176.9	-178.8	0	0	0	0	111.3	V10	V8-V10 PolarHBondContact O-N 2.79Å
9	E	22.3	Very low	27.5	Very low	122 Å²	122	123.8 Å²	123.8	57%	0.57	63%	0.628	S	S	*	*	H	α-helix	trans	-67.2	-34.7	178.7	-114	-179.4	175.6	0	0	113.3	R7 Y11 R12 K13	R7-E9 VanDerWaalsContact C-N 3.35Å; E9-Y11 VanDerWaalsContact C-N 3.32Å; E9-Y11 PolarHBondContact O-N 3.07Å; E9-R12 CarbonylContact O-C 3.56Å; E9-R12 PolarHBondContact O-N 2.83Å; E9-K13 WeakPolarHBondContact O-CB 3.39Å; E9-K13 PolarHBondContact O-N 3.09Å
10	V	23.8	Very low	27.6	Very low	96 Å²	96	118.3 Å²	118.3	58%	0.582	60%	0.601	S	S	*	*	H	α-helix	trans	-66.4	-33.4	-176	-178	0	0	0	0	112.3	V8 K13 V14	V8-V10 PolarHBondContact O-N 2.79Å; V10-K13 CarbonylContact O-C 3.28Å; V10-K13 WeakPolarHBondContact O-CA 3.49Å; V10-K13 PolarHBondContact O-N 2.85Å; V10-K13 VanDerWaalsContact O-N 3.13Å; V10-V14 PolarHBondContact O-N 2.92Å; V10-V14 VanDerWaalsContact O-N 3.13Å
11	Y	20.1	Very low	27.7	Very low	199 Å²	199	116.2 Å²	116.2	78%	0.78	59%	0.591	S	S	*	*	H	α-helix	trans	-76.3	-29.3	176.2	-79.4	-81.1	0	0	0	113.2	E9 K13	E9-Y11 VanDerWaalsContact C-N 3.32Å; E9-Y11 PolarHBondContact O-N 3.07Å; Y11-K13 VanDerWaalsContact C-N 3.28Å
12	R	23.7	Very low	27.7	Very low	224 Å²	224	109.7 Å²	109.7	85%	0.845	57%	0.567	S	S	*	*	H	α-helix	trans	-73.6	-20.8	164.4	-91.5	-172.9	-173.9	160.4	2.1	112.7	E9 G15	E9-R12 CarbonylContact O-C 3.56Å; E9-R12 PolarHBondContact O-N 2.83Å; R12-G15 PolarHBondContact O-N 3.33Å
13	K	27.1	Very low	27.4	Very low	151 Å²	151	104.5 Å²	104.5	66%	0.657	53%	0.532	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.4	6.7	-179.5	-144.5	173.2	-172.3	176.8	0	114.1	E9 V10 Y11 G15	E9-K13 WeakPolarHBondContact O-CB 3.39Å; E9-K13 PolarHBondContact O-N 3.09Å; V10-K13 CarbonylContact O-C 3.28Å; V10-K13 WeakPolarHBondContact O-CA 3.49Å; V10-K13 PolarHBondContact O-N 2.85Å; V10-K13 VanDerWaalsContact O-N 3.13Å; Y11-K13 VanDerWaalsContact C-N 3.28Å; K13-G15 VanDerWaalsContact O-CA 3.24Å; K13-G15 WeakPolarHBondContact O-CA 3.4Å; K13-G15 PolarHBondContact O-N 2.86Å
14	V	27.7	Very low	27.7	Very low	120 Å²	120	99.9 Å²	99.9	73%	0.727	51%	0.508	S	S	*	.	S	Bend	trans	-69.6	25.6	149.1	-160.5	0	0	0	0	110	V10	V10-V14 PolarHBondContact O-N 2.92Å; V10-V14 VanDerWaalsContact O-N 3.13Å
15	G	30.7	Very low	28	Very low	17 Å²	17	97 Å²	97	18%	0.175	49%	0.494	C	S	.	.				57.7	101.8	110.5	0	0	0	0	0	112.6	R12 K13 E17 G18	R12-G15 PolarHBondContact O-N 3.33Å; K13-G15 VanDerWaalsContact O-CA 3.24Å; K13-G15 WeakPolarHBondContact O-CA 3.4Å; K13-G15 PolarHBondContact O-N 2.86Å; G15-E17 PolarHBondContact O-N 3.46Å; G15-G18 PolarHBondContact O-N 3.39Å; G15-G18 VanDerWaalsContact O-N 3.11Å
16	S	36.5	Very low	28.4	Very low	22 Å²	22	99.3 Å²	99.3	15%	0.154	49%	0.492	C	S	.	.	T	Hydrogen-bonded Turn	trans	-31.6	-27.9	163.9	51	0	0	0	0	114.8	G18 Q19 V20 Y93	S16-G18 PolarHBondContact O-N 2.81Å; S16-Q19 PolarHBondContact O-N 3Å; S16-V20 WeakPolarHBondContact O-CB 3.34Å; S16-V20 WeakPolarHBondContact O-CG2 3.3Å; S16-V20 PolarHBondContact O-N 3.37Å; S16-Y93 PolarHBondContact OG-OH 3.41Å
17	E	31	Very low	28.7	Very low	127 Å²	127	94.8 Å²	94.8	59%	0.593	47%	0.472	S	S	*	.	H	α-helix	trans	-52.6	-41	177.2	-56.1	-168.7	147.7	0	0	114.6	G15 V20 L21 Y93	G15-E17 PolarHBondContact O-N 3.46Å; E17-V20 PolarHBondContact O-N 3.1Å; E17-L21 WeakPolarHBondContact O-CB 3.46Å; E17-L21 PolarHBondContact O-N 2.87Å; E17-Y93 HydrophobicContact CB-CE1 4.25Å; E17-Y93 HydrophobicContact CG-CE1 3.71Å; E17-Y93 VanDerWaalsContact CG-OH 3.26Å; E17-Y93 WeakPolarHBondContact CG-OH 3.24Å; E17-Y93 PolarHBondContact N-OH 3.27Å
18	G	26.7	Very low	29.3	Very low	51 Å²	51	89 Å²	89	53%	0.526	45%	0.452	S	S	.	.	H	α-helix	trans	-71.2	-40.7	-178	0	0	0	0	0	113.1	G15 S16 L21 C22	G15-G18 PolarHBondContact O-N 3.39Å; G15-G18 VanDerWaalsContact O-N 3.11Å; S16-G18 PolarHBondContact O-N 2.81Å; G18-L21 PolarHBondContact O-N 3.29Å; G18-C22 PolarHBondContact O-N 3.47Å
19	Q	30.1	Very low	29.8	Very low	114 Å²	114	87.4 Å²	87.4	53%	0.533	44%	0.44	S	S	.	.	H	α-helix	trans	-70.9	-38.1	172.6	-68	-172.3	-5.3	0	0	111	S16 L21 C22 V23	S16-Q19 PolarHBondContact O-N 3Å; Q19-L21 VanDerWaalsContact C-N 3.3Å; Q19-L21 PolarHBondContact O-N 2.86Å; Q19-C22 PolarHBondContact O-N 2.76Å; Q19-V23 WeakPolarHBondContact O-CB 3.32Å; Q19-V23 VanDerWaalsContact O-CG2 3.25Å; Q19-V23 WeakPolarHBondContact O-CG2 3.24Å; Q19-V23 PolarHBondContact O-N 3.28Å
20	V	30.2	Very low	30.2	Very low	14 Å²	14	86.4 Å²	86.4	9%	0.085	44%	0.435	C	S	.	.	H	α-helix	trans	-62.8	-35.2	175.4	167.3	0	0	0	0	111	S16 E17 V23 L24 L76 Y93	S16-V20 WeakPolarHBondContact O-CB 3.34Å; S16-V20 WeakPolarHBondContact O-CG2 3.3Å; S16-V20 PolarHBondContact O-N 3.37Å; E17-V20 PolarHBondContact O-N 3.1Å; V20-V23 CarbonylContact O-C 3.39Å; V20-V23 PolarHBondContact O-N 2.84Å; V20-L24 HydrophobicContact CG1-CD1 3.32Å; V20-L24 HydrophobicContact CG1-CG 3.98Å; V20-L24 WeakPolarHBondContact O-CB 3.42Å; V20-L24 WeakPolarHBondContact O-CD1 3.42Å; V20-L24 WeakPolarHBondContact O-CG 3.29Å; V20-L24 PolarHBondContact O-N 3.09Å; V20-L76 HydrophobicContact CG2-CD2 3.93Å; V20-Y93 HydrophobicContact CB-CE1 4.27Å; V20-Y93 HydrophobicContact CG1-CD1 3.88Å; V20-Y93 HydrophobicContact CG1-CE1 3.77Å; V20-Y93 HydrophobicContact CG1-CG 4.46Å
21	L	28.8	Very low	30.6	Very low	75 Å²	75	86 Å²	86	39%	0.393	43%	0.432	S	S	.	.	H	α-helix	trans	-65.6	-44.8	175.4	-154.9	80.1	0	0	0	111.8	E17 G18 Q19 V23 L24 V25	E17-L21 WeakPolarHBondContact O-CB 3.46Å; E17-L21 PolarHBondContact O-N 2.87Å; G18-L21 PolarHBondContact O-N 3.29Å; Q19-L21 VanDerWaalsContact C-N 3.3Å; Q19-L21 PolarHBondContact O-N 2.86Å; L21-V23 VanDerWaalsContact C-N 3.31Å; L21-V23 PolarHBondContact O-N 3.22Å; L21-L24 PolarHBondContact O-N 3.46Å; L21-V25 WeakPolarHBondContact O-CB 3.3Å; L21-V25 WeakPolarHBondContact O-CG2 3.16Å; L21-V25 PolarHBondContact O-N 3.36Å
22	C	30.4	Very low	31	Very low	84 Å²	84	81.1 Å²	81.1	57%	0.568	42%	0.418	S	S	*	.	H	α-helix	trans	-61.9	-39.5	173.5	-96.5	0	0	0	0	112.1	G18 Q19 K26	G18-C22 PolarHBondContact O-N 3.47Å; Q19-C22 PolarHBondContact O-N 2.76Å; C22-K26 WeakPolarHBondContact O-CB 3.2Å; C22-K26 WeakPolarHBondContact O-CG 3.48Å; C22-K26 PolarHBondContact O-N 3.15Å; C22-K26 VanDerWaalsContact O-N 3.08Å
23	V	30.3	Very low	31.5	Very low	13 Å²	13	79.4 Å²	79.4	8%	0.079	41%	0.411	C	S	.	.	H	α-helix	trans	-69.4	-40.4	176.6	172.2	0	0	0	0	110.7	Q19 V20 L21 K26 I27 L76	Q19-V23 WeakPolarHBondContact O-CB 3.32Å; Q19-V23 VanDerWaalsContact O-CG2 3.25Å; Q19-V23 WeakPolarHBondContact O-CG2 3.24Å; Q19-V23 PolarHBondContact O-N 3.28Å; V20-V23 CarbonylContact O-C 3.39Å; V20-V23 PolarHBondContact O-N 2.84Å; L21-V23 VanDerWaalsContact C-N 3.31Å; L21-V23 PolarHBondContact O-N 3.22Å; V23-K26 CarbonylContact O-C 3.45Å; V23-K26 PolarHBondContact O-N 2.69Å; V23-I27 HydrophobicContact CG1-CD1 3.49Å; V23-I27 VanDerWaalsContact CG1-CD1 3.49Å; V23-I27 HydrophobicContact CG1-CG1 4.12Å; V23-I27 WeakPolarHBondContact O-CB 2.7Å; V23-I27 WeakPolarHBondContact O-CG1 3.5Å; V23-I27 PolarHBondContact O-N 2.99Å; V23-L76 HydrophobicContact CG1-CD1 4.28Å; V23-L76 HydrophobicContact CG1-CD2 4.37Å; V23-L76 HydrophobicContact CG1-CG 4.15Å
24	L	33.4	Very low	31.7	Very low	31 Å²	31	77.4 Å²	77.4	16%	0.162	41%	0.408	C	S	.	.	H	α-helix	trans	-74.3	-35.9	-177.8	-75.8	166.1	0	0	0	113.1	V20 L21 I27 K28 L97	V20-L24 HydrophobicContact CG1-CD1 3.32Å; V20-L24 HydrophobicContact CG1-CG 3.98Å; V20-L24 WeakPolarHBondContact O-CB 3.42Å; V20-L24 WeakPolarHBondContact O-CD1 3.42Å; V20-L24 WeakPolarHBondContact O-CG 3.29Å; V20-L24 PolarHBondContact O-N 3.09Å; L21-L24 PolarHBondContact O-N 3.46Å; L24-I27 HydrophobicContact CD2-CD1 4.41Å; L24-I27 PolarHBondContact O-N 3.38Å; L24-K28 VanDerWaalsContact O-CB 3.3Å; L24-K28 WeakPolarHBondContact O-CB 3.41Å; L24-K28 PolarHBondContact O-N 2.79Å; L24-L97 HydrophobicContact CB-CD2 4.25Å; L24-L97 HydrophobicContact CD1-CD1 3.9Å; L24-L97 HydrophobicContact CD1-CD2 3.77Å; L24-L97 HydrophobicContact CD1-CG 3.97Å; L24-L97 HydrophobicContact CD2-CD1 3.49Å; L24-L97 VanDerWaalsContact CD2-CD1 3.49Å; L24-L97 HydrophobicContact CD2-CD2 3.92Å; L24-L97 HydrophobicContact CD2-CG 4.23Å; L24-L97 HydrophobicContact CG-CD1 4.3Å; L24-L97 HydrophobicContact CG-CD2 4.17Å
25	V	36.5	Very low	31.9	Very low	48 Å²	48	75.7 Å²	75.7	29%	0.291	41%	0.406	S	S	.	.	H	α-helix	trans	-66.1	-43.6	170.1	168.5	0	0	0	0	109.7	L21 I27 K28 L29 E189	L21-V25 WeakPolarHBondContact O-CB 3.3Å; L21-V25 WeakPolarHBondContact O-CG2 3.16Å; L21-V25 PolarHBondContact O-N 3.36Å; V25-I27 PolarHBondContact O-N 3.27Å; V25-K28 PolarHBondContact O-N 2.95Å; V25-L29 HydrophobicContact CG1-CD1 3.85Å; V25-L29 HydrophobicContact CG1-CG 4.49Å; V25-L29 VanDerWaalsContact O-CB 3.28Å; V25-L29 WeakPolarHBondContact O-CB 3.43Å; V25-L29 WeakPolarHBondContact O-CG 3.04Å; V25-L29 PolarHBondContact O-N 3.36Å; V25-E189 HydrophobicContact CG1-CG 4.18Å; V25-E189 WeakPolarHBondContact CG1-OE1 3.39Å; V25-E189 WeakPolarHBondContact CG1-OE2 3.31Å
26	K	35.3	Very low	32	Very low	147 Å²	147	76.8 Å²	76.8	64%	0.639	42%	0.418	S	S	*	.	H	α-helix	trans	-60.8	-42.4	171.8	-81.4	-178.2	176.1	-179	0	112.3	C22 V23 H30	C22-K26 WeakPolarHBondContact O-CB 3.2Å; C22-K26 WeakPolarHBondContact O-CG 3.48Å; C22-K26 PolarHBondContact O-N 3.15Å; C22-K26 VanDerWaalsContact O-N 3.08Å; V23-K26 CarbonylContact O-C 3.45Å; V23-K26 PolarHBondContact O-N 2.69Å; K26-H30 WeakPolarHBondContact O-CA 3.49Å; K26-H30 WeakPolarHBondContact O-CB 3.27Å; K26-H30 PolarHBondContact O-N 3.37Å
27	I	31.5	Very low	31.4	Very low	36 Å²	36	80.8 Å²	80.8	19%	0.185	43%	0.43	C	S	.	.	H	α-helix	trans	-66.4	-40.3	177.2	-71.1	166.5	0	0	0	109.9	V23 L24 V25 H30 V31 F73	V23-I27 HydrophobicContact CG1-CD1 3.49Å; V23-I27 VanDerWaalsContact CG1-CD1 3.49Å; V23-I27 HydrophobicContact CG1-CG1 4.12Å; V23-I27 WeakPolarHBondContact O-CB 2.7Å; V23-I27 WeakPolarHBondContact O-CG1 3.5Å; V23-I27 PolarHBondContact O-N 2.99Å; L24-I27 HydrophobicContact CD2-CD1 4.41Å; L24-I27 PolarHBondContact O-N 3.38Å; V25-I27 PolarHBondContact O-N 3.27Å; I27-H30 CarbonylContact O-C 3.47Å; I27-H30 PolarHBondContact O-N 2.74Å; I27-V31 HydrophobicContact CG2-CG2 3.94Å; I27-V31 WeakPolarHBondContact O-CA 3.35Å; I27-V31 WeakPolarHBondContact O-CB 3.42Å; I27-V31 WeakPolarHBondContact O-CG2 3.34Å; I27-V31 PolarHBondContact O-N 3.09Å; I27-F73 HydrophobicContact CD1-CD1 3.5Å; I27-F73 VanDerWaalsContact CD1-CD1 3.5Å; I27-F73 HydrophobicContact CD1-CD2 4.35Å; I27-F73 HydrophobicContact CD1-CE1 3.26Å; I27-F73 HydrophobicContact CD1-CE2 4.13Å; I27-F73 HydrophobicContact CD1-CG 4.06Å; I27-F73 HydrophobicContact CD1-CZ 3.59Å; I27-F73 HydrophobicContact CG1-CD1 3.76Å; I27-F73 HydrophobicContact CG1-CE1 3.36Å; I27-F73 HydrophobicContact CG1-CZ 4.05Å; I27-F73 HydrophobicContact CG2-CE1 4.46Å
28	K	36.5	Very low	31.4	Very low	74 Å²	74	78.3 Å²	78.3	32%	0.322	43%	0.425	S	S	.	.	H	α-helix	trans	-72.5	-38.7	179.6	-163.9	164.4	-178.2	-177	0	111.3	L24 V25 H30 V31 M32	L24-K28 VanDerWaalsContact O-CB 3.3Å; L24-K28 WeakPolarHBondContact O-CB 3.41Å; L24-K28 PolarHBondContact O-N 2.79Å; V25-K28 PolarHBondContact O-N 2.95Å; K28-H30 VanDerWaalsContact C-N 3.33Å; K28-V31 PolarHBondContact O-N 3.08Å; K28-M32 HydrophobicContact CG-SD 4.23Å; K28-M32 WeakPolarHBondContact O-CB 3.38Å; K28-M32 WeakPolarHBondContact O-CG 3.21Å; K28-M32 PolarHBondContact O-N 3.35Å
29	L	34.3	Very low	31.6	Very low	70 Å²	70	81.9 Å²	81.9	37%	0.366	44%	0.439	S	S	.	.	H	α-helix	trans	-63.3	-37.9	168.3	-79.1	165.9	0	0	0	111.9	V25 R33	V25-L29 HydrophobicContact CG1-CD1 3.85Å; V25-L29 HydrophobicContact CG1-CG 4.49Å; V25-L29 VanDerWaalsContact O-CB 3.28Å; V25-L29 WeakPolarHBondContact O-CB 3.43Å; V25-L29 WeakPolarHBondContact O-CG 3.04Å; V25-L29 PolarHBondContact O-N 3.36Å; L29-R33 WeakPolarHBondContact O-CB 3.43Å; L29-R33 PolarHBondContact O-N 3.39Å
30	H	30.3	Very low	31.4	Very low	102 Å²	102	83.7 Å²	83.7	47%	0.472	45%	0.451	S	S	.	.	H	α-helix	trans	-73.7	-38	177.8	-148.4	74.7	0	0	0	111.3	K26 I27 K28 M32 R33 D34	K26-H30 WeakPolarHBondContact O-CA 3.49Å; K26-H30 WeakPolarHBondContact O-CB 3.27Å; K26-H30 PolarHBondContact O-N 3.37Å; I27-H30 CarbonylContact O-C 3.47Å; I27-H30 PolarHBondContact O-N 2.74Å; K28-H30 VanDerWaalsContact C-N 3.33Å; H30-M32 VanDerWaalsContact C-N 3.35Å; H30-R33 CarbonylContact O-C 3.58Å; H30-R33 PolarHBondContact O-N 2.51Å; H30-D34 IonicContact CD2-OD2 2.74Å; H30-D34 PolarHBondContact CD2-OD2 3.15Å; H30-D34 VanDerWaalsContact CD2-OD2 3.26Å; H30-D34 IonicContact NE2-OD2 3.65Å; H30-D34 WeakPolarHBondContact O-CA 3.21Å; H30-D34 WeakPolarHBondContact O-CB 3.42Å; H30-D34 VanDerWaalsContact O-CG 3.29Å; H30-D34 PolarHBondContact O-N 2.7Å
31	V	30.8	Very low	31.2	Very low	87 Å²	87	91.5 Å²	91.5	53%	0.527	49%	0.487	S	S	.	.	H	α-helix	trans	-70.1	-33.4	173.6	168.1	0	0	0	0	110.4	I27 K28 R33 D34 A35	I27-V31 HydrophobicContact CG2-CG2 3.94Å; I27-V31 WeakPolarHBondContact O-CA 3.35Å; I27-V31 WeakPolarHBondContact O-CB 3.42Å; I27-V31 WeakPolarHBondContact O-CG2 3.34Å; I27-V31 PolarHBondContact O-N 3.09Å; K28-V31 PolarHBondContact O-N 3.08Å; V31-R33 VanDerWaalsContact C-N 3.35Å; V31-D34 CarbonylContact O-C 3.55Å; V31-D34 PolarHBondContact O-N 3.05Å; V31-A35 WeakPolarHBondContact O-CA 3.37Å; V31-A35 VanDerWaalsContact O-CB 3.26Å; V31-A35 WeakPolarHBondContact O-CB 3.14Å; V31-A35 PolarHBondContact O-N 3.01Å
32	M	29.6	Very low	31	Very low	96 Å²	96	98.8 Å²	98.8	47%	0.473	51%	0.511	S	S	.	.	H	α-helix	trans	-72.9	-29.4	170.5	-76.4	168.8	37.9	0	0	111.9	K28 H30	K28-M32 HydrophobicContact CG-SD 4.23Å; K28-M32 WeakPolarHBondContact O-CB 3.38Å; K28-M32 WeakPolarHBondContact O-CG 3.21Å; K28-M32 PolarHBondContact O-N 3.35Å; H30-M32 VanDerWaalsContact C-N 3.35Å
33	R	34.7	Very low	30.7	Very low	188 Å²	188	99.6 Å²	99.6	71%	0.709	51%	0.508	S	S	*	.	H	α-helix	trans	-76.5	-33.9	170.9	-179.1	-179.8	-94.6	-166.5	-7	111.9	L29 H30 V31	L29-R33 WeakPolarHBondContact O-CB 3.43Å; L29-R33 PolarHBondContact O-N 3.39Å; H30-R33 CarbonylContact O-C 3.58Å; H30-R33 PolarHBondContact O-N 2.51Å; V31-R33 VanDerWaalsContact C-N 3.35Å
34	D	31	Very low	30.6	Very low	109 Å²	109	107.2 Å²	107.2	58%	0.583	55%	0.549	S	S	*	.	H	α-helix	trans	-88.1	-5.5	177.9	-77	-13.1	0	0	0	112.4	H30 V31 G36	H30-D34 IonicContact CD2-OD2 2.74Å; H30-D34 PolarHBondContact CD2-OD2 3.15Å; H30-D34 VanDerWaalsContact CD2-OD2 3.26Å; H30-D34 IonicContact NE2-OD2 3.65Å; H30-D34 WeakPolarHBondContact O-CA 3.21Å; H30-D34 WeakPolarHBondContact O-CB 3.42Å; H30-D34 VanDerWaalsContact O-CG 3.29Å; H30-D34 PolarHBondContact O-N 2.7Å; V31-D34 CarbonylContact O-C 3.55Å; V31-D34 PolarHBondContact O-N 3.05Å; D34-G36 WeakPolarHBondContact O-CA 3.46Å; D34-G36 PolarHBondContact O-N 2.88Å
35	A	31.2	Very low	30.4	Very low	84 Å²	84	114.5 Å²	114.5	69%	0.694	58%	0.582	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.2	5.1	167	0	0	0	0	0	112.4	V31	V31-A35 WeakPolarHBondContact O-CA 3.37Å; V31-A35 VanDerWaalsContact O-CB 3.26Å; V31-A35 WeakPolarHBondContact O-CB 3.14Å; V31-A35 PolarHBondContact O-N 3.01Å
36	G	33.2	Very low	30	Very low	41 Å²	41	114.5 Å²	114.5	42%	0.423	58%	0.584	S	S	.	*	T	Hydrogen-bonded Turn	trans	131.9	51.7	134.6	0	0	0	0	0	117	D34	D34-G36 WeakPolarHBondContact O-CA 3.46Å; D34-G36 PolarHBondContact O-N 2.88Å
37	Y	24.8	Very low	29.7	Very low	106 Å²	106	112.2 Å²	112.2	42%	0.416	58%	0.584	S	S	.	*			trans	-127.9	98.7	161.6	-70.9	-90.9	0	0	0	111.8	D118 I121	Y37-D118 PolarHBondContact OH-OD1 2.82Å; Y37-I121 HydrophobicContact CD1-CB 3.95Å; Y37-I121 HydrophobicContact CD1-CD1 4.28Å; Y37-I121 HydrophobicContact CD1-CG2 3.43Å; Y37-I121 VanDerWaalsContact CD1-CG2 3.43Å; Y37-I121 HydrophobicContact CD2-CB 4.39Å; Y37-I121 HydrophobicContact CD2-CD1 3.28Å; Y37-I121 HydrophobicContact CD2-CG1 4.35Å; Y37-I121 HydrophobicContact CD2-CG2 3.93Å; Y37-I121 HydrophobicContact CE1-CB 4.08Å; Y37-I121 HydrophobicContact CE1-CD1 4.13Å; Y37-I121 HydrophobicContact CE1-CG2 4.1Å; Y37-I121 HydrophobicContact CE2-CD1 3.11Å; Y37-I121 HydrophobicContact CE2-CG1 4.36Å; Y37-I121 HydrophobicContact CG-CB 4.09Å; Y37-I121 HydrophobicContact CG-CD1 3.87Å; Y37-I121 HydrophobicContact CG-CG2 3.32Å
38	P	30.6	Very low	29.5	Very low	75 Å²	75	115.8 Å²	115.8	49%	0.487	60%	0.603	S	S	.	*			trans	-92	149.4	-172.3	35.3	-31.5	0	0	0	111.9	L40 I43	P38-L40 PolarHBondContact O-N 3.36Å; P38-I43 HydrophobicContact CB-CD1 4.42Å
39	P	29.9	Very low	29	Very low	125 Å²	125	118.5 Å²	118.5	81%	0.812	62%	0.618	S	S	*	*			trans	-64	113.6	152.4	-17.7	32	0	0	0	109.1	H41	P39-H41 PolarHBondContact O-N 3.21Å
40	L	26.1	Very low	28.8	Very low	152 Å²	152	123.4 Å²	123.4	80%	0.796	64%	0.637	S	S	*	*	S	Bend	trans	-61	115.4	180	-65.6	162.7	0	0	0	111.2	P38	P38-L40 PolarHBondContact O-N 3.36Å
41	H	27	Very low	28.7	Very low	179 Å²	179	122.5 Å²	122.5	83%	0.829	63%	0.634	S	S	*	*	S	Bend	trans	157.7	126.5	139	-96.8	-94	0	0	0	106.6	P39	P39-H41 PolarHBondContact O-N 3.21Å
42	Y	24.3	Very low	28.5	Very low	227 Å²	227	121 Å²	121	89%	0.89	63%	0.631	S	S	*	*			trans	85.3	53.2	179.5	-97.2	-93.3	0	0	0	119.1
43	I	24.5	Very low	28.5	Very low	102 Å²	102	123 Å²	123	52%	0.523	64%	0.643	S	S	.	*			trans	-126.1	16.1	168	-57.6	178.7	0	0	0	114	P38 Q45	P38-I43 HydrophobicContact CB-CD1 4.42Å; I43-Q45 PolarHBondContact O-N 3.46Å
44	N	27.1	Very low	28.2	Very low	173 Å²	173	120.4 Å²	120.4	93%	0.925	64%	0.639	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.9	7.7	170.2	-85.4	-16	0	0	0	114.7
45	Q	29.6	Very low	28.1	Very low	183 Å²	183	122.3 Å²	122.3	86%	0.855	65%	0.649	S	S	*	*	T	Hydrogen-bonded Turn	trans	-142.5	18.6	179.7	-64.3	-170.2	-3.8	0	0	115.8	I43 P47	I43-Q45 PolarHBondContact O-N 3.46Å; Q45-P47 WeakPolarHBondContact O-CD 3.21Å
46	S	28.2	Very low	28	Very low	48 Å²	48	121.7 Å²	121.7	34%	0.336	64%	0.637	S	S	.	*			trans	-77.8	130.1	176.3	104	0	0	0	0	111.4	L48 M49	S46-L48 PolarHBondContact O-N 3.2Å; S46-M49 PolarHBondContact O-N 2.93Å
47	P	29.3	Very low	27.6	Very low	100 Å²	100	128.6 Å²	128.6	65%	0.649	65%	0.65	S	S	*	*	H	α-helix	trans	-58.5	-17.3	179.5	-27	35.1	0	0	0	115.2	Q45 K50	Q45-P47 WeakPolarHBondContact O-CD 3.21Å; P47-K50 PolarHBondContact O-N 3.39Å
48	L	26.8	Very low	27.9	Very low	111 Å²	111	135 Å²	135	58%	0.581	67%	0.674	S	S	*	*	H	α-helix	trans	-67.6	-37.1	178.8	-101.9	157.3	0	0	0	112.8	S46 K50 M51 A52	S46-L48 PolarHBondContact O-N 3.2Å; L48-K50 VanDerWaalsContact C-N 3.28Å; L48-K50 PolarHBondContact O-N 3.15Å; L48-M51 HydrophobicContact CD2-CE 3.71Å; L48-M51 HydrophobicContact CG-CE 3.91Å; L48-M51 PolarHBondContact O-N 3.34Å; L48-A52 PolarHBondContact O-N 3.04Å; L48-A52 VanDerWaalsContact O-N 3.12Å
49	M	26.1	Very low	27.9	Very low	130 Å²	130	140.4 Å²	140.4	64%	0.64	69%	0.689	S	S	*	*	H	α-helix	trans	-68.8	-27.4	177.4	-108	-64.1	173.8	0	0	112.7	S46 M51 A52 N53	S46-M49 PolarHBondContact O-N 2.93Å; M49-M51 VanDerWaalsContact C-N 3.26Å; M49-M51 PolarHBondContact O-N 2.75Å; M49-A52 PolarHBondContact O-N 3.02Å; M49-A52 HydrophobicContact SD-CB 4.31Å; M49-N53 PolarHBondContact O-N 3.38Å
50	K	30.6	Very low	27.9	Very low	173 Å²	173	136.7 Å²	136.7	75%	0.752	67%	0.674	S	S	*	*	H	α-helix	trans	-67.8	-27.4	171.2	-70.6	-175.1	178.9	178.2	0	112.4	P47 L48	P47-K50 PolarHBondContact O-N 3.39Å; L48-K50 VanDerWaalsContact C-N 3.28Å; L48-K50 PolarHBondContact O-N 3.15Å
51	M	26.6	Very low	28.5	Very low	84 Å²	84	133.5 Å²	133.5	41%	0.414	66%	0.663	S	S	.	*	H	α-helix	trans	-81.4	-32.2	175.8	-69.4	-173	-66.1	0	0	112.7	L48 M49 T56	L48-M51 HydrophobicContact CD2-CE 3.71Å; L48-M51 HydrophobicContact CG-CE 3.91Å; L48-M51 PolarHBondContact O-N 3.34Å; M49-M51 VanDerWaalsContact C-N 3.26Å; M49-M51 PolarHBondContact O-N 2.75Å; M51-T56 PolarHBondContact O-OG1 2.84Å
52	A	27.9	Very low	28.9	Very low	55 Å²	55	132.2 Å²	132.2	46%	0.455	66%	0.657	S	S	.	*	H	α-helix	trans	-70.5	-36.2	179.3	0	0	0	0	0	113.1	L48 M49	L48-A52 PolarHBondContact O-N 3.04Å; L48-A52 VanDerWaalsContact O-N 3.12Å; M49-A52 PolarHBondContact O-N 3.02Å; M49-A52 HydrophobicContact SD-CB 4.31Å
53	N	29.2	Very low	29.4	Very low	139 Å²	139	126.1 Å²	126.1	74%	0.743	65%	0.646	S	S	*	*	S	Bend	trans	-82	-13.9	-177.5	-156.3	-7.5	0	0	0	113.6	M49	M49-N53 PolarHBondContact O-N 3.38Å
54	Q	28.3	Very low	29.8	Very low	132 Å²	132	127.1 Å²	127.1	62%	0.617	65%	0.653	S	S	*	*	S	Bend	trans	-92.3	125.1	167.2	-68.6	-174.4	0.8	0	0	107.6	T56	Q54-T56 HydrophobicContact CB-CG2 3.9Å; Q54-T56 PolarHBondContact O-N 3.12Å; Q54-T56 PolarHBondContact O-OG1 3.37Å; Q54-T56 VanDerWaalsContact O-OG1 3.04Å
55	N	28.5	Very low	30.2	Very low	150 Å²	150	123.5 Å²	123.5	80%	0.802	63%	0.629	S	S	*	*	S	Bend	trans	-55.6	39.3	176	-65.7	-49.5	0	0	0	114.9
56	T	28.7	Very low	30.5	Very low	70 Å²	70	118.8 Å²	118.8	43%	0.429	62%	0.622	S	S	.	*	G	3₁₀ helix	trans	-85.8	-16.8	-173.9	53.9	0	0	0	0	111.8	M51 Q54 R58 K59	M51-T56 PolarHBondContact O-OG1 2.84Å; Q54-T56 HydrophobicContact CB-CG2 3.9Å; Q54-T56 PolarHBondContact O-N 3.12Å; Q54-T56 PolarHBondContact O-OG1 3.37Å; Q54-T56 VanDerWaalsContact O-OG1 3.04Å; T56-R58 PolarHBondContact O-N 3.48Å; T56-K59 CarbonylContact O-C 3.54Å; T56-K59 PolarHBondContact O-N 3.09Å
57	W	26.4	Very low	31.2	Very low	187 Å²	187	127 Å²	127	71%	0.708	65%	0.645	S	S	*	*	G	3₁₀ helix	trans	-63.9	-20.5	170.5	-66.9	105.7	0	0	0	113.9	K59	W57-K59 PolarHBondContact O-N 3.34Å
58	R	29.9	Very low	31.7	Very low	241 Å²	241	129.3 Å²	129.3	91%	0.909	65%	0.652	S	S	*	*	G	3₁₀ helix	trans	-68.2	-22	170.6	-77.7	-107	-139	-158.9	1.4	112.8	T56	T56-R58 PolarHBondContact O-N 3.48Å
59	K	31.3	Very low	32.4	Very low	187 Å²	187	126 Å²	126	81%	0.813	64%	0.641	S	S	*	*	S	Bend	trans	-102.9	96.2	169.5	-72.1	-167.5	177.7	-176.5	0	106.9	T56 W57	T56-K59 CarbonylContact O-C 3.54Å; T56-K59 PolarHBondContact O-N 3.09Å; W57-K59 PolarHBondContact O-N 3.34Å
60	G	29.3	Very low	33.1	Very low	47 Å²	47	121.3 Å²	121.3	49%	0.485	62%	0.618	S	S	.	*			trans	-47.9	164	-166.5	0	0	0	0	0	115.7	Q62	G60-Q62 PolarHBondContact O-N 3.02Å
61	P	38.7	Very low	33.6	Very low	86 Å²	86	117.4 Å²	117.4	56%	0.558	61%	0.613	S	S	*	*	S	Bend	trans	-68.3	22.9	-165.6	27.9	-35.5	0	0	0	115.7	C63	P61-C63 VanDerWaalsContact C-N 3.28Å; P61-C63 PolarHBondContact O-N 3.3Å; P61-C63 VanDerWaalsContact O-N 3.14Å
62	Q	35.8	Very low	34.3	Very low	152 Å²	152	120.2 Å²	120.2	71%	0.71	63%	0.625	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.4	-11.2	-170	-77.4	-174	8.4	0	0	115.6	G60	G60-Q62 PolarHBondContact O-N 3.02Å
63	C	34.2	Very low	34.9	Very low	99 Å²	99	120.2 Å²	120.2	67%	0.669	62%	0.615	S	S	*	*	T	Hydrogen-bonded Turn	trans	-138.3	13.1	-168	-56.2	0	0	0	0	118.4	P61	P61-C63 VanDerWaalsContact C-N 3.28Å; P61-C63 PolarHBondContact O-N 3.3Å; P61-C63 VanDerWaalsContact O-N 3.14Å
64	N	33.9	Very low	35.5	Very low	122 Å²	122	121.4 Å²	121.4	65%	0.652	62%	0.616	S	S	*	*	S	Bend	trans	-97.2	-22.2	173	-76.3	-11.3	0	0	0	114.2	A66 R67	N64-A66 VanDerWaalsContact C-N 3.26Å; N64-A66 PolarHBondContact O-N 2.97Å; N64-R67 PolarHBondContact O-N 3.2Å
65	F	33.8	Very low	36.2	Very low	97 Å²	97	118.1 Å²	118.1	43%	0.425	61%	0.607	S	S	.	*	T	Hydrogen-bonded Turn	trans	-66.5	-26.6	175.7	-94.1	-84.3	0	0	0	113.5	R67 L70 V90	F65-R67 PolarHBondContact O-N 2.77Å; F65-L70 HydrophobicContact CD1-CD2 3.82Å; F65-L70 HydrophobicContact CE1-CD2 3.89Å; F65-V90 HydrophobicContact CB-CG1 3.69Å; F65-V90 HydrophobicContact CG-CG1 4.11Å
66	A	36.6	Very low	36.8	Very low	85 Å²	85	111.6 Å²	111.6	70%	0.702	57%	0.573	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.4	-16.4	-178.6	0	0	0	0	0	113.5	N64 D68	N64-A66 VanDerWaalsContact C-N 3.26Å; N64-A66 PolarHBondContact O-N 2.97Å; A66-D68 VanDerWaalsContact C-N 3.35Å; A66-D68 PolarHBondContact O-N 3.47Å
67	R	42.4	Very low	37.4	Very low	219 Å²	219	110.8 Å²	110.8	83%	0.826	57%	0.567	S	S	*	*	S	Bend	trans	-98.3	44.6	-172	-150.6	-177.9	179.3	-171.9	-0.9	113.2	N64 F65 A69	N64-R67 PolarHBondContact O-N 3.2Å; F65-R67 PolarHBondContact O-N 2.77Å; R67-A69 PolarHBondContact O-N 3.03Å
68	D	40.1	Very low	38.3	Very low	149 Å²	149	108.3 Å²	108.3	80%	0.797	56%	0.564	S	S	*	*	S	Bend	trans	57.9	12.1	170.1	-104.3	-9.3	0	0	0	116.8	A66 L70	A66-D68 VanDerWaalsContact C-N 3.35Å; A66-D68 PolarHBondContact O-N 3.47Å; D68-L70 PolarHBondContact O-N 3.26Å
69	A	41.9	Very low	39	Very low	43 Å²	43	98 Å²	98	36%	0.355	53%	0.527	S	S	.	.	G	3₁₀ helix	trans	-78.3	20.8	-178.5	0	0	0	0	0	113.9	R67 S71	R67-A69 PolarHBondContact O-N 3.03Å; A69-S71 PolarHBondContact O-N 3.37Å
70	L	40.8	Very low	39.4	Very low	30 Å²	30	90.8 Å²	90.8	16%	0.157	51%	0.507	C	S	.	.	G	3₁₀ helix	trans	-68.5	-10.3	170.5	-63.2	-177.2	0	0	0	112.2	F65 D68 Q72 F73 L76 I85	F65-L70 HydrophobicContact CD1-CD2 3.82Å; F65-L70 HydrophobicContact CE1-CD2 3.89Å; D68-L70 PolarHBondContact O-N 3.26Å; L70-Q72 PolarHBondContact O-N 3.19Å; L70-Q72 VanDerWaalsContact O-N 3.15Å; L70-F73 CarbonylContact O-C 3.48Å; L70-F73 WeakPolarHBondContact O-CA 3.44Å; L70-F73 PolarHBondContact O-N 3.49Å; L70-F73 VanDerWaalsContact O-O 3.08Å; L70-L76 HydrophobicContact CB-CB 4.25Å; L70-L76 HydrophobicContact CD1-CB 4.46Å; L70-L76 HydrophobicContact CD2-CB 4.42Å; L70-L76 HydrophobicContact CD2-CD1 3.77Å; L70-I85 HydrophobicContact CD1-CD1 3.96Å
71	S	40.9	Very low	40.3	Very low	92 Å²	92	95.8 Å²	95.8	64%	0.643	52%	0.522	S	S	*	.	G	3₁₀ helix	trans	-56.5	-24.7	174.1	56.5	0	0	0	0	113.8	A69 F73	A69-S71 PolarHBondContact O-N 3.37Å; S71-F73 PolarHBondContact O-N 3.21Å
72	Q	41.2	Very low	40.7	Very low	143 Å²	143	100.3 Å²	100.3	67%	0.668	54%	0.536	S	S	*	.	G	3₁₀ helix	trans	-68.6	-23.2	173.8	-62.7	-178.4	19.6	0	0	112.6	L70	L70-Q72 PolarHBondContact O-N 3.19Å; L70-Q72 VanDerWaalsContact O-N 3.15Å
73	F	40.5	Very low	41.1	Very low	55 Å²	55	95.8 Å²	95.8	24%	0.241	52%	0.524	C	S	.	.			trans	-111.4	91.9	-179.9	-55.7	-63.4	0	0	0	108.9	I27 L70 S71 S75 L76 T77	I27-F73 HydrophobicContact CD1-CD1 3.5Å; I27-F73 VanDerWaalsContact CD1-CD1 3.5Å; I27-F73 HydrophobicContact CD1-CD2 4.35Å; I27-F73 HydrophobicContact CD1-CE1 3.26Å; I27-F73 HydrophobicContact CD1-CE2 4.13Å; I27-F73 HydrophobicContact CD1-CG 4.06Å; I27-F73 HydrophobicContact CD1-CZ 3.59Å; I27-F73 HydrophobicContact CG1-CD1 3.76Å; I27-F73 HydrophobicContact CG1-CE1 3.36Å; I27-F73 HydrophobicContact CG1-CZ 4.05Å; I27-F73 HydrophobicContact CG2-CE1 4.46Å; L70-F73 CarbonylContact O-C 3.48Å; L70-F73 WeakPolarHBondContact O-CA 3.44Å; L70-F73 PolarHBondContact O-N 3.49Å; L70-F73 VanDerWaalsContact O-O 3.08Å; S71-F73 PolarHBondContact O-N 3.21Å; F73-S75 PolarHBondContact O-N 3.43Å; F73-L76 HydrophobicContact CB-CB 3.99Å; F73-L76 HydrophobicContact CB-CD1 3.77Å; F73-L76 HydrophobicContact CB-CG 3.83Å; F73-L76 HydrophobicContact CD2-CD1 3.9Å; F73-L76 HydrophobicContact CG-CD1 4.05Å; F73-L76 WeakPolarHBondContact O-CA 3.33Å; F73-L76 PolarHBondContact O-N 2.96Å; F73-T77 PolarHBondContact O-N 2.86Å; F73-T77 VanDerWaalsContact O-N 3.16Å
74	Q	42.4	Very low	41.9	Very low	164 Å²	164	95.8 Å²	95.8	77%	0.766	53%	0.532	S	S	*	.	H	α-helix	trans	-54.9	-25.5	178.4	-168.2	179.6	2	0	0	113.2	L76 T77	Q74-L76 VanDerWaalsContact C-N 3.35Å; Q74-T77 PolarHBondContact O-OG1 2.93Å
75	S	43.3	Very low	42.8	Very low	62 Å²	62	92.2 Å²	92.2	43%	0.434	51%	0.512	S	S	.	.	H	α-helix	trans	-71.9	-26.4	173.1	-55.6	0	0	0	0	113.6	F73	F73-S75 PolarHBondContact O-N 3.43Å
76	L	40.1	Very low	44	Very low	14 Å²	14	90.5 Å²	90.5	7%	0.073	51%	0.512	C	S	.	.	H	α-helix	trans	-90.4	-20.3	178	-61.8	179.4	0	0	0	112.8	V20 V23 L70 F73 Q74 Q78 V79 G80	V20-L76 HydrophobicContact CG2-CD2 3.93Å; V23-L76 HydrophobicContact CG1-CD1 4.28Å; V23-L76 HydrophobicContact CG1-CD2 4.37Å; V23-L76 HydrophobicContact CG1-CG 4.15Å; L70-L76 HydrophobicContact CB-CB 4.25Å; L70-L76 HydrophobicContact CD1-CB 4.46Å; L70-L76 HydrophobicContact CD2-CB 4.42Å; L70-L76 HydrophobicContact CD2-CD1 3.77Å; F73-L76 HydrophobicContact CB-CB 3.99Å; F73-L76 HydrophobicContact CB-CD1 3.77Å; F73-L76 HydrophobicContact CB-CG 3.83Å; F73-L76 HydrophobicContact CD2-CD1 3.9Å; F73-L76 HydrophobicContact CG-CD1 4.05Å; F73-L76 WeakPolarHBondContact O-CA 3.33Å; F73-L76 PolarHBondContact O-N 2.96Å; Q74-L76 VanDerWaalsContact C-N 3.35Å; L76-Q78 PolarHBondContact O-N 3.18Å; L76-V79 WeakPolarHBondContact O-CB 3.48Å; L76-V79 PolarHBondContact O-N 3.28Å; L76-G80 PolarHBondContact O-N 3.08Å
77	T	42.7	Very low	44.9	Very low	52 Å²	52	92 Å²	92	32%	0.319	51%	0.505	S	S	.	.	H	α-helix	trans	-62.5	-32.1	173.2	58.6	0	0	0	0	111.8	F73 Q74 V79 G80 N81	F73-T77 PolarHBondContact O-N 2.86Å; F73-T77 VanDerWaalsContact O-N 3.16Å; Q74-T77 PolarHBondContact O-OG1 2.93Å; T77-V79 VanDerWaalsContact C-N 3.29Å; T77-V79 PolarHBondContact O-N 3.18Å; T77-G80 PolarHBondContact O-N 3.33Å; T77-N81 PolarHBondContact O-N 3.04Å
78	Q	45.2	Very low	45.9	Very low	136 Å²	136	85 Å²	85	64%	0.636	49%	0.493	S	S	*	.	H	α-helix	trans	-62.1	-36.5	171.2	-71	-176.7	7.7	0	0	112.2	L76	L76-Q78 PolarHBondContact O-N 3.18Å
79	V	43.1	Very low	46.4	Very low	23 Å²	23	83.6 Å²	83.6	14%	0.139	48%	0.477	C	S	.	.	H	α-helix	trans	-76.2	-36	178	-175.8	0	0	0	0	111.3	L76 T77 N81 E82 A83 I85	L76-V79 WeakPolarHBondContact O-CB 3.48Å; L76-V79 PolarHBondContact O-N 3.28Å; T77-V79 VanDerWaalsContact C-N 3.29Å; T77-V79 PolarHBondContact O-N 3.18Å; V79-N81 VanDerWaalsContact C-N 3.27Å; V79-N81 PolarHBondContact O-N 3.43Å; V79-E82 PolarHBondContact O-N 3.42Å; V79-A83 PolarHBondContact O-N 2.62Å; V79-I85 HydrophobicContact CB-CD1 4.49Å; V79-I85 HydrophobicContact CG1-CD1 3.81Å; V79-I85 HydrophobicContact CG1-CG1 4.07Å
80	G	41	Very low	47.2	Very low	37 Å²	37	83 Å²	83	38%	0.381	47%	0.469	S	S	.	.	H	α-helix	trans	-61.6	-31	-179.9	0	0	0	0	0	114	L76 T77	L76-G80 PolarHBondContact O-N 3.08Å; T77-G80 PolarHBondContact O-N 3.33Å
81	N	48.4	Very low	48.3	Very low	151 Å²	151	86.5 Å²	86.5	81%	0.807	48%	0.483	S	S	*	.	H	α-helix	trans	-75.3	-26.5	179.4	-70.9	-15	0	0	0	113.7	T77 V79	T77-N81 PolarHBondContact O-N 3.04Å; V79-N81 VanDerWaalsContact C-N 3.27Å; V79-N81 PolarHBondContact O-N 3.43Å
82	E	46	Very low	49.2	Very low	182 Å²	182	85.4 Å²	85.4	85%	0.85	48%	0.475	S	S	*	.	H	α-helix	trans	-97.6	-22.5	-174.2	-73.9	-169.4	163.8	0	0	114.1	V79	V79-E82 PolarHBondContact O-N 3.42Å
83	A	45.4	Very low	50	Low	56 Å²	56	80 Å²	80	46%	0.463	45%	0.449	S	S	.	.			trans	-162.1	124.8	171.1	0	0	0	0	0	109.7	V79 I85	V79-A83 PolarHBondContact O-N 2.62Å; A83-I85 PolarHBondContact O-N 3.42Å
84	A	51.3	Low	51.1	Low	100 Å²	100	79.5 Å²	79.5	83%	0.826	45%	0.452	S	S	*	.			trans	-48.6	109.1	162.7	0	0	0	0	0	108.4	S86	A84-S86 PolarHBondContact O-N 3.17Å
85	I	52.6	Low	52.3	Low	47 Å²	47	79.7 Å²	79.7	24%	0.241	45%	0.45	C	S	.	.			trans	-64.6	113.3	-177.4	-57.8	177	0	0	0	106.2	L70 V79 A83 E87 R89 V90	L70-I85 HydrophobicContact CD1-CD1 3.96Å; V79-I85 HydrophobicContact CB-CD1 4.49Å; V79-I85 HydrophobicContact CG1-CD1 3.81Å; V79-I85 HydrophobicContact CG1-CG1 4.07Å; A83-I85 PolarHBondContact O-N 3.42Å; I85-E87 PolarHBondContact O-N 3.46Å; I85-R89 HydrophobicContact CG2-CB 3.99Å; I85-V90 HydrophobicContact CB-CG2 4.48Å; I85-V90 HydrophobicContact CG2-CG2 3.75Å
86	S	57.5	Low	53.2	Low	61 Å²	61	81.2 Å²	81.2	43%	0.427	45%	0.45	S	S	.	.			trans	-58.9	141.1	-177.8	66.3	0	0	0	0	110.6	A84 A88 R89 V90	A84-S86 PolarHBondContact O-N 3.17Å; S86-A88 PolarHBondContact O-N 2.92Å; S86-A88 VanDerWaalsContact O-N 3.08Å; S86-R89 WeakPolarHBondContact O-CA 3.3Å; S86-R89 WeakPolarHBondContact O-CB 3.48Å; S86-R89 PolarHBondContact O-N 3.36Å; S86-V90 PolarHBondContact O-N 3.13Å
87	E	57.1	Low	54.3	Low	117 Å²	117	83.2 Å²	83.2	55%	0.547	46%	0.461	S	S	.	.	H	α-helix	trans	-53.1	-34.1	178.8	-167.5	-165.3	145.2	0	0	111.8	I85 R89 V90 K91	I85-E87 PolarHBondContact O-N 3.46Å; E87-R89 PolarHBondContact O-N 3.47Å; E87-V90 PolarHBondContact O-N 3.18Å; E87-K91 WeakPolarHBondContact O-CB 3.31Å; E87-K91 PolarHBondContact O-N 3.04Å; E87-K91 WeakPolarHBondContact OE1-CE 3.23Å; E87-K91 IonicContact OE1-NZ 3.79Å; E87-K91 PolarHBondContact OE1-NZ 3.34Å
88	A	61.7	Low	55.6	Low	71 Å²	71	85.5 Å²	85.5	59%	0.587	47%	0.467	S	S	*	.	H	α-helix	trans	-60.1	-40.5	174.4	0	0	0	0	0	112.9	S86 S92	S86-A88 PolarHBondContact O-N 2.92Å; S86-A88 VanDerWaalsContact O-N 3.08Å; A88-S92 PolarHBondContact O-N 3.36Å
89	R	51.8	Low	56.8	Low	119 Å²	119	81.6 Å²	81.6	45%	0.449	46%	0.459	S	S	.	.	H	α-helix	trans	-67.6	-45.4	174.8	-83.5	-174	166.5	-178.3	-1.2	111.3	I85 S86 E87 K91 S92 Y93	I85-R89 HydrophobicContact CG2-CB 3.99Å; S86-R89 WeakPolarHBondContact O-CA 3.3Å; S86-R89 WeakPolarHBondContact O-CB 3.48Å; S86-R89 PolarHBondContact O-N 3.36Å; E87-R89 PolarHBondContact O-N 3.47Å; R89-K91 VanDerWaalsContact C-N 3.3Å; R89-K91 PolarHBondContact O-N 3.13Å; R89-S92 WeakPolarHBondContact O-CA 3.33Å; R89-S92 WeakPolarHBondContact O-CB 3.4Å; R89-S92 PolarHBondContact O-N 3.47Å; R89-Y93 HydrophobicContact CB-CD2 4.49Å; R89-Y93 HydrophobicContact CB-CE2 4.15Å; R89-Y93 WeakPolarHBondContact O-CD2 3.44Å; R89-Y93 PolarHBondContact O-N 3.4Å
90	V	59.3	Low	58	Low	32 Å²	32	84.1 Å²	84.1	19%	0.194	47%	0.471	C	S	.	.	H	α-helix	trans	-55.7	-47.6	175.8	-179.7	0	0	0	0	110.4	F65 I85 S86 E87 S92 Y93 C94	F65-V90 HydrophobicContact CB-CG1 3.69Å; F65-V90 HydrophobicContact CG-CG1 4.11Å; I85-V90 HydrophobicContact CB-CG2 4.48Å; I85-V90 HydrophobicContact CG2-CG2 3.75Å; S86-V90 PolarHBondContact O-N 3.13Å; E87-V90 PolarHBondContact O-N 3.18Å; V90-S92 VanDerWaalsContact C-N 3.33Å; V90-S92 PolarHBondContact O-N 2.77Å; V90-Y93 WeakPolarHBondContact O-CB 3.28Å; V90-Y93 PolarHBondContact O-N 3.3Å; V90-Y93 VanDerWaalsContact O-N 3.17Å; V90-C94 PolarHBondContact O-N 3.28Å; V90-C94 PolarHBondContact O-SG 3.46Å
91	K	62.7	Low	59.2	Low	102 Å²	102	86.4 Å²	86.4	44%	0.443	47%	0.472	S	S	.	.	H	α-helix	trans	-58.4	-42.3	174.4	-84.1	171.4	170.7	159.7	0	112.7	E87 R89 Y93 C94 K95	E87-K91 WeakPolarHBondContact O-CB 3.31Å; E87-K91 PolarHBondContact O-N 3.04Å; E87-K91 WeakPolarHBondContact OE1-CE 3.23Å; E87-K91 IonicContact OE1-NZ 3.79Å; E87-K91 PolarHBondContact OE1-NZ 3.34Å; R89-K91 VanDerWaalsContact C-N 3.3Å; R89-K91 PolarHBondContact O-N 3.13Å; K91-Y93 VanDerWaalsContact C-N 3.35Å; K91-C94 PolarHBondContact O-N 2.91Å; K91-K95 WeakPolarHBondContact O-CB 3.46Å; K91-K95 PolarHBondContact O-N 3.26Å
92	S	60.9	Low	60.3	Low	69 Å²	69	83 Å²	83	48%	0.483	45%	0.454	S	S	.	.	H	α-helix	trans	-60.5	-44.2	175.5	-169.1	0	0	0	0	111.7	A88 R89 V90 K95 H96	A88-S92 PolarHBondContact O-N 3.36Å; R89-S92 WeakPolarHBondContact O-CA 3.33Å; R89-S92 WeakPolarHBondContact O-CB 3.4Å; R89-S92 PolarHBondContact O-N 3.47Å; V90-S92 VanDerWaalsContact C-N 3.33Å; V90-S92 PolarHBondContact O-N 2.77Å; S92-K95 PolarHBondContact O-N 3.07Å; S92-H96 PolarHBondContact O-N 3.25Å
93	Y	56.9	Low	61.5	Low	30 Å²	30	76.1 Å²	76.1	12%	0.118	42%	0.422	C	S	.	.	H	α-helix	trans	-63.5	-45.9	175.2	-69.3	-62.3	0	0	0	112.3	S16 E17 V20 R89 V90 K91 K95 H96 L97	S16-Y93 PolarHBondContact OG-OH 3.41Å; E17-Y93 HydrophobicContact CB-CE1 4.25Å; E17-Y93 HydrophobicContact CG-CE1 3.71Å; E17-Y93 VanDerWaalsContact CG-OH 3.26Å; E17-Y93 WeakPolarHBondContact CG-OH 3.24Å; E17-Y93 PolarHBondContact N-OH 3.27Å; V20-Y93 HydrophobicContact CB-CE1 4.27Å; V20-Y93 HydrophobicContact CG1-CD1 3.88Å; V20-Y93 HydrophobicContact CG1-CE1 3.77Å; V20-Y93 HydrophobicContact CG1-CG 4.46Å; R89-Y93 HydrophobicContact CB-CD2 4.49Å; R89-Y93 HydrophobicContact CB-CE2 4.15Å; R89-Y93 WeakPolarHBondContact O-CD2 3.44Å; R89-Y93 PolarHBondContact O-N 3.4Å; V90-Y93 WeakPolarHBondContact O-CB 3.28Å; V90-Y93 PolarHBondContact O-N 3.3Å; V90-Y93 VanDerWaalsContact O-N 3.17Å; K91-Y93 VanDerWaalsContact C-N 3.35Å; Y93-K95 VanDerWaalsContact C-N 3.26Å; Y93-K95 PolarHBondContact O-N 3.39Å; Y93-H96 PolarHBondContact O-N 3.35Å; Y93-L97 WeakPolarHBondContact O-CB 3.45Å; Y93-L97 WeakPolarHBondContact O-CG 3.44Å; Y93-L97 PolarHBondContact O-N 3.35Å
94	C	63.8	Low	62.2	Low	45 Å²	45	75.9 Å²	75.9	30%	0.304	41%	0.411	S	S	.	.	H	α-helix	trans	-58.2	-41.4	175.8	-66	0	0	0	0	111.2	V90 K91 L97 Q98	V90-C94 PolarHBondContact O-N 3.28Å; V90-C94 PolarHBondContact O-SG 3.46Å; K91-C94 PolarHBondContact O-N 2.91Å; C94-L97 PolarHBondContact O-N 3.4Å; C94-Q98 WeakPolarHBondContact O-CB 3.26Å; C94-Q98 PolarHBondContact O-N 2.72Å
95	K	66.9	Low	62.9	Low	168 Å²	168	73.7 Å²	73.7	73%	0.73	39%	0.388	S	S	*	.	H	α-helix	trans	-65	-43.1	176.7	-171.5	177.8	-179	179.6	0	112	K91 S92 Y93 Q98 A99	K91-K95 WeakPolarHBondContact O-CB 3.46Å; K91-K95 PolarHBondContact O-N 3.26Å; S92-K95 PolarHBondContact O-N 3.07Å; Y93-K95 VanDerWaalsContact C-N 3.26Å; Y93-K95 PolarHBondContact O-N 3.39Å; K95-Q98 PolarHBondContact O-N 2.88Å; K95-A99 PolarHBondContact O-N 3.47Å
96	H	62.8	Low	63.9	Low	93 Å²	93	80.3 Å²	80.3	43%	0.431	41%	0.41	S	S	.	.	H	α-helix	trans	-64.2	-43.3	176.4	179.7	63.2	0	0	0	111.9	S92 Y93 Q98 A99 L100	S92-H96 PolarHBondContact O-N 3.25Å; Y93-H96 PolarHBondContact O-N 3.35Å; H96-Q98 VanDerWaalsContact C-N 3.34Å; H96-Q98 PolarHBondContact O-N 3.45Å; H96-A99 PolarHBondContact O-N 3.31Å; H96-L100 VanDerWaalsContact NE2-CD1 3.34Å; H96-L100 WeakPolarHBondContact NE2-CD1 3.44Å; H96-L100 WeakPolarHBondContact O-CG 3.41Å; H96-L100 PolarHBondContact O-N 3.24Å
97	L	63.5	Low	64.4	Low	57 Å²	57	84.2 Å²	84.2	30%	0.298	42%	0.415	S	S	.	.	H	α-helix	trans	-62.5	-41	175.9	-79.4	171.5	0	0	0	112.6	L24 Y93 C94 L100 H101	L24-L97 HydrophobicContact CB-CD2 4.25Å; L24-L97 HydrophobicContact CD1-CD1 3.9Å; L24-L97 HydrophobicContact CD1-CD2 3.77Å; L24-L97 HydrophobicContact CD1-CG 3.97Å; L24-L97 HydrophobicContact CD2-CD1 3.49Å; L24-L97 VanDerWaalsContact CD2-CD1 3.49Å; L24-L97 HydrophobicContact CD2-CD2 3.92Å; L24-L97 HydrophobicContact CD2-CG 4.23Å; L24-L97 HydrophobicContact CG-CD1 4.3Å; L24-L97 HydrophobicContact CG-CD2 4.17Å; Y93-L97 WeakPolarHBondContact O-CB 3.45Å; Y93-L97 WeakPolarHBondContact O-CG 3.44Å; Y93-L97 PolarHBondContact O-N 3.35Å; C94-L97 PolarHBondContact O-N 3.4Å; L97-L100 PolarHBondContact O-N 3.35Å; L97-H101 WeakPolarHBondContact O-CB 3.26Å; L97-H101 PolarHBondContact O-N 3.01Å
98	Q	70.1	Confident	64.8	Low	99 Å²	99	81 Å²	81	46%	0.463	40%	0.399	S	S	.	.	H	α-helix	trans	-61.6	-47.6	173.5	-170.3	63.3	53.1	0	0	110.3	C94 K95 H96 L100 H101 D102	C94-Q98 WeakPolarHBondContact O-CB 3.26Å; C94-Q98 PolarHBondContact O-N 2.72Å; K95-Q98 PolarHBondContact O-N 2.88Å; H96-Q98 VanDerWaalsContact C-N 3.34Å; H96-Q98 PolarHBondContact O-N 3.45Å; Q98-L100 VanDerWaalsContact C-N 3.32Å; Q98-L100 PolarHBondContact O-N 3.07Å; Q98-H101 WeakPolarHBondContact O-CB 3.32Å; Q98-H101 PolarHBondContact O-N 3.01Å; Q98-H101 VanDerWaalsContact O-N 3.15Å; Q98-D102 PolarHBondContact NE2-OD1 2.63Å; Q98-D102 WeakPolarHBondContact O-CB 3.46Å; Q98-D102 PolarHBondContact O-N 3.17Å
99	A	69.9	Low	65.3	Low	55 Å²	55	81.1 Å²	81.1	46%	0.455	39%	0.394	S	S	.	.	H	α-helix	trans	-60.9	-39.2	177.6	0	0	0	0	0	112.8	K95 H96 D102 D103	K95-A99 PolarHBondContact O-N 3.47Å; H96-A99 PolarHBondContact O-N 3.31Å; A99-D102 PolarHBondContact O-N 3.05Å; A99-D103 WeakPolarHBondContact O-CB 3.45Å; A99-D103 PolarHBondContact O-N 2.97Å
100	L	68.3	Low	65.9	Low	75 Å²	75	80.3 Å²	80.3	39%	0.393	40%	0.399	S	S	.	.	H	α-helix	trans	-66.5	-41.7	174	-78.5	177.2	0	0	0	112.1	H96 L97 Q98 D103 F104	H96-L100 VanDerWaalsContact NE2-CD1 3.34Å; H96-L100 WeakPolarHBondContact NE2-CD1 3.44Å; H96-L100 WeakPolarHBondContact O-CG 3.41Å; H96-L100 PolarHBondContact O-N 3.24Å; L97-L100 PolarHBondContact O-N 3.35Å; Q98-L100 VanDerWaalsContact C-N 3.32Å; Q98-L100 PolarHBondContact O-N 3.07Å; L100-D103 PolarHBondContact O-N 2.75Å; L100-F104 WeakPolarHBondContact O-CB 3.48Å; L100-F104 PolarHBondContact O-N 3.21Å
101	H	66.8	Low	66.1	Low	85 Å²	85	80.3 Å²	80.3	39%	0.394	40%	0.397	S	S	.	.	H	α-helix	trans	-60.6	-48.9	174.6	173.7	-85.2	0	0	0	110.6	L97 Q98 D103 F104 T105	L97-H101 WeakPolarHBondContact O-CB 3.26Å; L97-H101 PolarHBondContact O-N 3.01Å; Q98-H101 WeakPolarHBondContact O-CB 3.32Å; Q98-H101 PolarHBondContact O-N 3.01Å; Q98-H101 VanDerWaalsContact O-N 3.15Å; H101-D103 VanDerWaalsContact C-N 3.31Å; H101-D103 PolarHBondContact O-N 3.36Å; H101-F104 PolarHBondContact O-N 3.32Å; H101-T105 PolarHBondContact CE1-OG1 3.22Å; H101-T105 WeakPolarHBondContact O-CB 3.41Å; H101-T105 PolarHBondContact O-N 3.41Å; H101-T105 PolarHBondContact O-OG1 2.97Å
102	D	71.6	Confident	66.1	Low	81 Å²	81	79.8 Å²	79.8	43%	0.433	40%	0.399	S	S	.	.	H	α-helix	trans	-62.5	-40.1	-179.7	-60.7	-16.4	0	0	0	111.3	Q98 A99 R106	Q98-D102 PolarHBondContact NE2-OD1 2.63Å; Q98-D102 WeakPolarHBondContact O-CB 3.46Å; Q98-D102 PolarHBondContact O-N 3.17Å; A99-D102 PolarHBondContact O-N 3.05Å; D102-R106 VanDerWaalsContact O-CB 3.27Å; D102-R106 WeakPolarHBondContact O-CB 3.24Å; D102-R106 PolarHBondContact O-N 3.17Å
103	D	70.1	Confident	66.5	Low	36 Å²	36	80.8 Å²	80.8	19%	0.193	41%	0.406	C	S	.	.	H	α-helix	trans	-66.6	-41.1	175.1	-174.2	64	0	0	0	112.2	A99 L100 H101 R106 R107	A99-D103 WeakPolarHBondContact O-CB 3.45Å; A99-D103 PolarHBondContact O-N 2.97Å; L100-D103 PolarHBondContact O-N 2.75Å; H101-D103 VanDerWaalsContact C-N 3.31Å; H101-D103 PolarHBondContact O-N 3.36Å; D103-R106 PolarHBondContact O-N 3.42Å; D103-R106 IonicContact OD1-CZ 3.26Å; D103-R106 IonicContact OD1-NE 3.58Å; D103-R106 IonicContact OD1-NH2 2.95Å; D103-R106 PolarHBondContact OD1-NH2 3.44Å; D103-R107 VanDerWaalsContact CG-NH2 3.33Å; D103-R107 WeakPolarHBondContact O-CB 2.76Å; D103-R107 VanDerWaalsContact O-CG 3.27Å; D103-R107 WeakPolarHBondContact O-CG 3.38Å; D103-R107 PolarHBondContact O-N 3.04Å; D103-R107 IonicContact OD1-CZ 3.79Å; D103-R107 IonicContact OD1-NE 3.8Å; D103-R107 PolarHBondContact OD1-NE 3.38Å; D103-R107 IonicContact OD1-NH2 3.39Å; D103-R107 PolarHBondContact OD1-NH2 3.05Å; D103-R107 IonicContact OD2-CZ 3.71Å; D103-R107 IonicContact OD2-NE 3.93Å; D103-R107 PolarHBondContact OD2-NE 3.28Å; D103-R107 IonicContact OD2-NH1 2.92Å; D103-R107 IonicContact OD2-NH2 2.88Å; D103-R107 PolarHBondContact OD2-NH2 3.01Å
104	F	59.9	Low	67	Low	51 Å²	51	81.8 Å²	81.8	22%	0.224	41%	0.412	C	S	.	.	H	α-helix	trans	-64.7	-44.6	176.2	-158.3	-94.8	0	0	0	111.3	L100 H101 R106 R107 F108 L112	L100-F104 WeakPolarHBondContact O-CB 3.48Å; L100-F104 PolarHBondContact O-N 3.21Å; H101-F104 PolarHBondContact O-N 3.32Å; F104-R106 VanDerWaalsContact C-N 3.28Å; F104-R106 PolarHBondContact O-N 3.12Å; F104-R107 PolarHBondContact O-N 3.37Å; F104-F108 HydrophobicContact CD1-CD2 4.12Å; F104-F108 AromaticContact CD2-CD2 3.63Å; F104-F108 HydrophobicContact CD2-CD2 3.63Å; F104-F108 AromaticContact CD2-CE2 3.82Å; F104-F108 HydrophobicContact CD2-CE2 3.82Å; F104-F108 HydrophobicContact CE1-CB 4.33Å; F104-F108 HydrophobicContact CE1-CD2 4.04Å; F104-F108 AromaticContact CE2-CD2 3.55Å; F104-F108 HydrophobicContact CE2-CD2 3.55Å; F104-F108 AromaticContact CE2-CE2 3.66Å; F104-F108 HydrophobicContact CE2-CE2 3.66Å; F104-F108 AromaticContact CG-CD2 3.93Å; F104-F108 HydrophobicContact CG-CD2 3.93Å; F104-F108 AromaticContact CZ-CD2 3.76Å; F104-F108 HydrophobicContact CZ-CD2 3.76Å; F104-F108 HydrophobicContact CZ-CE2 4.25Å; F104-F108 HydrophobicContact CZ-CG 4.38Å; F104-F108 PolarHBondContact O-N 3.25Å; F104-L112 HydrophobicContact CD1-CD2 4.25Å; F104-L112 HydrophobicContact CE1-CD2 4.26Å
105	T	66.2	Low	67.4	Low	55 Å²	55	85.6 Å²	85.6	34%	0.337	43%	0.434	S	S	.	.	H	α-helix	trans	-62.7	-35.7	176.6	-58.3	0	0	0	0	112.6	H101 L112	H101-T105 PolarHBondContact CE1-OG1 3.22Å; H101-T105 WeakPolarHBondContact O-CB 3.41Å; H101-T105 PolarHBondContact O-N 3.41Å; H101-T105 PolarHBondContact O-OG1 2.97Å; T105-L112 VanDerWaalsContact CA-CD1 3.46Å; T105-L112 HydrophobicContact CG2-CD1 3.91Å; T105-L112 VanDerWaalsContact OG1-CD1 3.32Å; T105-L112 WeakPolarHBondContact OG1-CD1 3.44Å
106	R	74.8	Confident	67.7	Low	186 Å²	186	80.7 Å²	80.7	70%	0.702	42%	0.415	S	S	*	.	H	α-helix	trans	-71.9	-36.2	175.3	-176.2	179.2	62.9	167.8	-1.7	112.9	D102 D103 F104	D102-R106 VanDerWaalsContact O-CB 3.27Å; D102-R106 WeakPolarHBondContact O-CB 3.24Å; D102-R106 PolarHBondContact O-N 3.17Å; D103-R106 PolarHBondContact O-N 3.42Å; D103-R106 IonicContact OD1-CZ 3.26Å; D103-R106 IonicContact OD1-NE 3.58Å; D103-R106 IonicContact OD1-NH2 2.95Å; D103-R106 PolarHBondContact OD1-NH2 3.44Å; F104-R106 VanDerWaalsContact C-N 3.28Å; F104-R106 PolarHBondContact O-N 3.12Å
107	R	66.7	Low	68.1	Low	142 Å²	142	77.4 Å²	77.4	54%	0.536	40%	0.402	S	S	.	.	H	α-helix	trans	-85.3	-32.3	-175.2	-72.3	-178.9	-164.5	-164.3	11.2	113.8	D103 F104 P109	D103-R107 VanDerWaalsContact CG-NH2 3.33Å; D103-R107 WeakPolarHBondContact O-CB 2.76Å; D103-R107 VanDerWaalsContact O-CG 3.27Å; D103-R107 WeakPolarHBondContact O-CG 3.38Å; D103-R107 PolarHBondContact O-N 3.04Å; D103-R107 IonicContact OD1-CZ 3.79Å; D103-R107 IonicContact OD1-NE 3.8Å; D103-R107 PolarHBondContact OD1-NE 3.38Å; D103-R107 IonicContact OD1-NH2 3.39Å; D103-R107 PolarHBondContact OD1-NH2 3.05Å; D103-R107 IonicContact OD2-CZ 3.71Å; D103-R107 IonicContact OD2-NE 3.93Å; D103-R107 PolarHBondContact OD2-NE 3.28Å; D103-R107 IonicContact OD2-NH1 2.92Å; D103-R107 IonicContact OD2-NH2 2.88Å; D103-R107 PolarHBondContact OD2-NH2 3.01Å; F104-R107 PolarHBondContact O-N 3.37Å; R107-P109 WeakPolarHBondContact O-CD 3.24Å
108	F	66.4	Low	68.8	Low	50 Å²	50	78.7 Å²	78.7	22%	0.219	41%	0.409	C	S	.	.			trans	-126.9	50.8	-174.5	-52.2	-72.3	0	0	0	111.7	F104 D110 I111 L112	F104-F108 HydrophobicContact CD1-CD2 4.12Å; F104-F108 AromaticContact CD2-CD2 3.63Å; F104-F108 HydrophobicContact CD2-CD2 3.63Å; F104-F108 AromaticContact CD2-CE2 3.82Å; F104-F108 HydrophobicContact CD2-CE2 3.82Å; F104-F108 HydrophobicContact CE1-CB 4.33Å; F104-F108 HydrophobicContact CE1-CD2 4.04Å; F104-F108 AromaticContact CE2-CD2 3.55Å; F104-F108 HydrophobicContact CE2-CD2 3.55Å; F104-F108 AromaticContact CE2-CE2 3.66Å; F104-F108 HydrophobicContact CE2-CE2 3.66Å; F104-F108 AromaticContact CG-CD2 3.93Å; F104-F108 HydrophobicContact CG-CD2 3.93Å; F104-F108 AromaticContact CZ-CD2 3.76Å; F104-F108 HydrophobicContact CZ-CD2 3.76Å; F104-F108 HydrophobicContact CZ-CE2 4.25Å; F104-F108 HydrophobicContact CZ-CG 4.38Å; F104-F108 PolarHBondContact O-N 3.25Å; F108-D110 VanDerWaalsContact C-OD1 3.22Å; F108-D110 VanDerWaalsContact CA-OD1 3.3Å; F108-D110 WeakPolarHBondContact CA-OD1 3.27Å; F108-D110 PolarHBondContact O-N 3.43Å; F108-I111 HydrophobicContact CB-CB 4.06Å; F108-I111 HydrophobicContact CB-CD1 4Å; F108-I111 HydrophobicContact CB-CG1 4.11Å; F108-I111 HydrophobicContact CD1-CD1 3.73Å; F108-I111 HydrophobicContact CG-CD1 4.09Å; F108-I111 PolarHBondContact O-N 3.5Å; F108-L112 WeakPolarHBondContact O-CG 3.31Å; F108-L112 PolarHBondContact O-N 2.94Å
109	P	71.4	Confident	69.3	Low	74 Å²	74	74.1 Å²	74.1	48%	0.481	39%	0.387	S	S	.	.	H	α-helix	trans	-61.8	-34.4	179.2	28.6	-34.7	0	0	0	111.1	R107 L112 S113	R107-P109 WeakPolarHBondContact O-CD 3.24Å; P109-L112 PolarHBondContact O-N 3.2Å; P109-S113 WeakPolarHBondContact O-CB 3.36Å; P109-S113 PolarHBondContact O-N 2.96Å; P109-S113 PolarHBondContact O-OG 3.36Å
110	D	65	Low	69.6	Low	101 Å²	101	72 Å²	72	54%	0.54	37%	0.368	S	S	.	.	H	α-helix	trans	-59	-51.6	175	58.8	-31.7	0	0	0	111.7	F108 L112 S113 M114	F108-D110 VanDerWaalsContact C-OD1 3.22Å; F108-D110 VanDerWaalsContact CA-OD1 3.3Å; F108-D110 WeakPolarHBondContact CA-OD1 3.27Å; F108-D110 PolarHBondContact O-N 3.43Å; D110-L112 PolarHBondContact O-N 2.87Å; D110-S113 WeakPolarHBondContact CA-OG 3.32Å; D110-S113 PolarHBondContact O-N 3.01Å; D110-S113 PolarHBondContact O-OG 3.4Å; D110-M114 PolarHBondContact O-N 3.29Å
111	I	62.7	Low	69.8	Low	33 Å²	33	69.9 Å²	69.9	17%	0.169	36%	0.358	C	S	.	.	H	α-helix	trans	-65	-40.4	179.7	-56.1	-178.7	0	0	0	110.8	F108 S113 M114	F108-I111 HydrophobicContact CB-CB 4.06Å; F108-I111 HydrophobicContact CB-CD1 4Å; F108-I111 HydrophobicContact CB-CG1 4.11Å; F108-I111 HydrophobicContact CD1-CD1 3.73Å; F108-I111 HydrophobicContact CG-CD1 4.09Å; F108-I111 PolarHBondContact O-N 3.5Å; I111-S113 VanDerWaalsContact C-N 3.34Å; I111-M114 WeakPolarHBondContact O-CB 3.46Å; I111-M114 PolarHBondContact O-N 2.84Å
112	L	63.6	Low	70.3	Confident	91 Å²	91	69.1 Å²	69.1	48%	0.476	36%	0.356	S	S	.	.	H	α-helix	trans	-71.7	-29.2	178.7	-67.4	-175	0	0	0	113.3	F104 T105 F108 P109 D110 M114	F104-L112 HydrophobicContact CD1-CD2 4.25Å; F104-L112 HydrophobicContact CE1-CD2 4.26Å; T105-L112 VanDerWaalsContact CA-CD1 3.46Å; T105-L112 HydrophobicContact CG2-CD1 3.91Å; T105-L112 VanDerWaalsContact OG1-CD1 3.32Å; T105-L112 WeakPolarHBondContact OG1-CD1 3.44Å; F108-L112 WeakPolarHBondContact O-CG 3.31Å; F108-L112 PolarHBondContact O-N 2.94Å; P109-L112 PolarHBondContact O-N 3.2Å; D110-L112 PolarHBondContact O-N 2.87Å; L112-M114 VanDerWaalsContact C-N 3.29Å
113	S	69.6	Low	70.3	Confident	89 Å²	89	65.4 Å²	65.4	62%	0.622	34%	0.337	S	S	*	.	H	α-helix	trans	-83.7	-5.4	174.6	69.1	0	0	0	0	113.5	P109 D110 I111 V115	P109-S113 WeakPolarHBondContact O-CB 3.36Å; P109-S113 PolarHBondContact O-N 2.96Å; P109-S113 PolarHBondContact O-OG 3.36Å; D110-S113 WeakPolarHBondContact CA-OG 3.32Å; D110-S113 PolarHBondContact O-N 3.01Å; D110-S113 PolarHBondContact O-OG 3.4Å; I111-S113 VanDerWaalsContact C-N 3.34Å; S113-V115 PolarHBondContact O-N 3.39Å
114	M	67.2	Low	70.4	Confident	51 Å²	51	67.2 Å²	67.2	25%	0.251	35%	0.346	S	S	.	.	P	Polyproline II helix	trans	-67.1	116.5	-176.5	-168.7	171.4	71.5	0	0	109.9	D110 I111 L112 I116 L178 C181	D110-M114 PolarHBondContact O-N 3.29Å; I111-M114 WeakPolarHBondContact O-CB 3.46Å; I111-M114 PolarHBondContact O-N 2.84Å; L112-M114 VanDerWaalsContact C-N 3.29Å; M114-I116 HydrophobicContact CE-CG1 4.29Å; M114-I116 PolarHBondContact O-N 3.49Å; M114-L178 HydrophobicContact CE-CD2 3.82Å; M114-L178 HydrophobicContact CG-CD2 3.93Å; M114-L178 HydrophobicContact SD-CD2 3.51Å; M114-L178 VanDerWaalsContact SD-CD2 3.51Å; M114-C181 HydrophobicContact CE-CB 4.29Å; M114-C181 HydrophobicContact SD-CB 4.15Å
115	V	71.5	Confident	71.3	Confident	125 Å²	125	66.6 Å²	66.6	76%	0.758	35%	0.346	S	S	*	.	P	Polyproline II helix	trans	-79.4	119.4	171.5	-179.3	0	0	0	0	107.4	S113 P117	S113-V115 PolarHBondContact O-N 3.39Å; V115-P117 WeakPolarHBondContact O-CD 3.43Å
116	I	72.9	Confident	71.6	Confident	65 Å²	65	69.6 Å²	69.6	33%	0.333	36%	0.36	S	S	.	.	P	Polyproline II helix	trans	-91.4	117.1	172.7	-57.6	173.1	0	0	0	106.6	M114 V120 I121	M114-I116 HydrophobicContact CE-CG1 4.29Å; M114-I116 PolarHBondContact O-N 3.49Å; I116-V120 HydrophobicContact CG2-CB 4.22Å; I116-V120 HydrophobicContact CG2-CG1 4.36Å; I116-I121 HydrophobicContact CG2-CD1 3.84Å; I116-I121 HydrophobicContact CG2-CG1 4.15Å
117	P	72.5	Confident	71.6	Confident	25 Å²	25	61.3 Å²	61.3	16%	0.162	33%	0.33	C	S	.	.	P	Polyproline II helix	trans	-62.1	141.9	177	-22.6	33	0	0	0	112	V115 W119 V120 E130	V115-P117 WeakPolarHBondContact O-CD 3.43Å; P117-W119 VanDerWaalsContact CB-CD1 3.47Å; P117-W119 HydrophobicContact CB-CD2 4.36Å; P117-W119 HydrophobicContact CB-CG 4.2Å; P117-W119 HydrophobicContact CB-CZ2 4.44Å; P117-W119 HydrophobicContact CG-CZ2 4.41Å; P117-W119 PolarHBondContact O-N 2.84Å; P117-V120 HydrophobicContact CB-CG2 4.15Å; P117-V120 HydrophobicContact CG-CG2 4.23Å; P117-V120 WeakPolarHBondContact O-CB 3.21Å; P117-V120 PolarHBondContact O-N 2.98Å; P117-E130 WeakPolarHBondContact CB-OE1 3.27Å
118	D	77.4	Confident	71.7	Confident	83 Å²	83	60.3 Å²	60.3	44%	0.444	34%	0.335	S	S	.	.	H	α-helix	trans	-56.6	-36.6	-179.3	-76.7	-41	0	0	0	112.4	Y37 V120 I121 N122 T125	Y37-D118 PolarHBondContact OH-OD1 2.82Å; D118-V120 PolarHBondContact O-N 3.4Å; D118-I121 PolarHBondContact O-N 3.49Å; D118-I121 VanDerWaalsContact O-N 3.08Å; D118-N122 PolarHBondContact O-N 3.5Å; D118-T125 HydrophobicContact CB-CG2 3.86Å
119	W	80.6	Confident	71.9	Confident	4 Å²	4	65.6 Å²	65.6	2%	0.015	37%	0.366	C	S	.	.	H	α-helix	trans	-65.1	-24.4	-179.4	66.8	-102	0	0	0	113.2	P117 I121 N122 P123 L127 E130 L138 W159 V171 V174 V175	P117-W119 VanDerWaalsContact CB-CD1 3.47Å; P117-W119 HydrophobicContact CB-CD2 4.36Å; P117-W119 HydrophobicContact CB-CG 4.2Å; P117-W119 HydrophobicContact CB-CZ2 4.44Å; P117-W119 HydrophobicContact CG-CZ2 4.41Å; P117-W119 PolarHBondContact O-N 2.84Å; W119-I121 PolarHBondContact O-N 3.47Å; W119-N122 VanDerWaalsContact CA-O 3.3Å; W119-N122 WeakPolarHBondContact CA-O 3.16Å; W119-N122 CarbonylContact O-C 3.26Å; W119-N122 VanDerWaalsContact O-C 3.26Å; W119-P123 WeakPolarHBondContact O-CA 3.17Å; W119-P123 VanDerWaalsContact O-N 3.07Å; W119-L127 HydrophobicContact CB-CD2 4.02Å; W119-L127 HydrophobicContact CG-CD2 4.26Å; W119-E130 VanDerWaalsContact CD1-OE1 3.31Å; W119-E130 PolarHBondContact NE1-OE1 3.03Å; W119-L138 HydrophobicContact CD2-CD1 3.77Å; W119-L138 HydrophobicContact CD2-CD2 3.9Å; W119-L138 HydrophobicContact CE3-CD1 4.26Å; W119-L138 HydrophobicContact CE3-CD2 3.56Å; W119-L138 HydrophobicContact CG-CD1 3.9Å; W119-L138 HydrophobicContact CG-CD2 4.34Å; W119-L138 HydrophobicContact CZ2-CD1 4.47Å; W119-L138 HydrophobicContact CZ3-CD2 4.08Å; W119-W159 AromaticContact CE3-CH2 3.96Å; W119-W159 HydrophobicContact CE3-CH2 3.96Å; W119-W159 AromaticContact CE3-CZ2 3.89Å; W119-W159 HydrophobicContact CE3-CZ2 3.89Å; W119-W159 AromaticContact CZ3-CH2 3.7Å; W119-W159 HydrophobicContact CZ3-CH2 3.7Å; W119-W159 AromaticContact CZ3-CZ2 3.81Å; W119-W159 HydrophobicContact CZ3-CZ2 3.81Å; W119-V171 HydrophobicContact CE3-CG1 4.1Å; W119-V171 HydrophobicContact CH2-CG1 3.7Å; W119-V171 HydrophobicContact CZ3-CG1 3.3Å; W119-V174 HydrophobicContact CH2-CB 4Å; W119-V174 HydrophobicContact CH2-CG1 3.99Å; W119-V174 HydrophobicContact CZ2-CB 4.23Å; W119-V174 HydrophobicContact CZ2-CG1 3.87Å; W119-V175 HydrophobicContact CH2-CG2 3.76Å; W119-V175 HydrophobicContact CZ3-CG2 3.48Å; W119-V175 VanDerWaalsContact CZ3-CG2 3.48Å
120	V	76.5	Confident	72.1	Confident	9 Å²	9	64.3 Å²	64.3	6%	0.055	35%	0.353	C	S	.	.	H	α-helix	trans	-66.1	-32.5	175.9	175.4	0	0	0	0	110.4	I116 P117 D118 W159 V175 L178	I116-V120 HydrophobicContact CG2-CB 4.22Å; I116-V120 HydrophobicContact CG2-CG1 4.36Å; P117-V120 HydrophobicContact CB-CG2 4.15Å; P117-V120 HydrophobicContact CG-CG2 4.23Å; P117-V120 WeakPolarHBondContact O-CB 3.21Å; P117-V120 PolarHBondContact O-N 2.98Å; D118-V120 PolarHBondContact O-N 3.4Å; V120-W159 PolarHBondContact O-NE1 2.76Å; V120-V175 HydrophobicContact CG1-CG2 4.31Å; V120-V175 HydrophobicContact CG2-CG2 4.23Å; V120-L178 HydrophobicContact CB-CD1 4.41Å; V120-L178 HydrophobicContact CG1-CD1 4.14Å; V120-L178 HydrophobicContact CG2-CD1 3.66Å
121	I	71.7	Confident	72.8	Confident	32 Å²	32	66.1 Å²	66.1	16%	0.164	36%	0.359	C	S	.	.	H	α-helix	trans	-95.3	-38.9	-175.8	-58	171.3	0	0	0	110.6	Y37 I116 D118 W119 Y155	Y37-I121 HydrophobicContact CD1-CB 3.95Å; Y37-I121 HydrophobicContact CD1-CD1 4.28Å; Y37-I121 HydrophobicContact CD1-CG2 3.43Å; Y37-I121 VanDerWaalsContact CD1-CG2 3.43Å; Y37-I121 HydrophobicContact CD2-CB 4.39Å; Y37-I121 HydrophobicContact CD2-CD1 3.28Å; Y37-I121 HydrophobicContact CD2-CG1 4.35Å; Y37-I121 HydrophobicContact CD2-CG2 3.93Å; Y37-I121 HydrophobicContact CE1-CB 4.08Å; Y37-I121 HydrophobicContact CE1-CD1 4.13Å; Y37-I121 HydrophobicContact CE1-CG2 4.1Å; Y37-I121 HydrophobicContact CE2-CD1 3.11Å; Y37-I121 HydrophobicContact CE2-CG1 4.36Å; Y37-I121 HydrophobicContact CG-CB 4.09Å; Y37-I121 HydrophobicContact CG-CD1 3.87Å; Y37-I121 HydrophobicContact CG-CG2 3.32Å; I116-I121 HydrophobicContact CG2-CD1 3.84Å; I116-I121 HydrophobicContact CG2-CG1 4.15Å; D118-I121 PolarHBondContact O-N 3.49Å; D118-I121 VanDerWaalsContact O-N 3.08Å; W119-I121 PolarHBondContact O-N 3.47Å; I121-Y155 HydrophobicContact CG2-CD1 4.23Å
122	N	78	Confident	73.7	Confident	68 Å²	68	70.3 Å²	70.3	36%	0.364	38%	0.38	S	S	.	.			trans	-128.9	98.6	169.7	175.5	22	0	0	0	109.7	D118 W119 L124 T125	D118-N122 PolarHBondContact O-N 3.5Å; W119-N122 VanDerWaalsContact CA-O 3.3Å; W119-N122 WeakPolarHBondContact CA-O 3.16Å; W119-N122 CarbonylContact O-C 3.26Å; W119-N122 VanDerWaalsContact O-C 3.26Å; N122-L124 PolarHBondContact O-N 2.65Å; N122-L124 WeakPolarHBondContact OD1-CB 3.46Å; N122-L124 PolarHBondContact OD1-N 3.2Å; N122-T125 WeakPolarHBondContact CB-OG1 3.15Å; N122-T125 PolarHBondContact ND2-OG1 2.71Å; N122-T125 VanDerWaalsContact ND2-OG1 3.15Å; N122-T125 WeakPolarHBondContact O-CB 3.21Å; N122-T125 PolarHBondContact O-N 2.84Å; N122-T125 PolarHBondContact O-OG1 3.26Å
123	P	71.5	Confident	74.5	Confident	4 Å²	4	68.8 Å²	68.8	3%	0.026	38%	0.377	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.1	-13.7	-179	-22.1	30.4	0	0	0	114.6	W119 T125 L141 Q142 F158 W159	W119-P123 WeakPolarHBondContact O-CA 3.17Å; W119-P123 VanDerWaalsContact O-N 3.07Å; P123-T125 VanDerWaalsContact C-N 3.33Å; P123-L141 HydrophobicContact CB-CD2 3.56Å; P123-Q142 WeakPolarHBondContact O-CG 3.49Å; P123-Q142 PolarHBondContact O-NE2 3.14Å; P123-F158 HydrophobicContact CB-CE1 4.14Å; P123-F158 HydrophobicContact CB-CZ 4.43Å; P123-F158 HydrophobicContact CG-CD1 3.85Å; P123-F158 HydrophobicContact CG-CE1 3.51Å; P123-F158 HydrophobicContact CG-CZ 4.12Å; P123-W159 HydrophobicContact CB-CZ2 4.38Å; P123-W159 HydrophobicContact CG-CH2 4.43Å; P123-W159 HydrophobicContact CG-CZ2 3.84Å
124	L	73.1	Confident	75.2	Confident	74 Å²	74	65.3 Å²	65.3	39%	0.387	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.3	10.2	179.8	-47.2	-177.8	0	0	0	113.6	N122 Q142 K148	N122-L124 PolarHBondContact O-N 2.65Å; N122-L124 WeakPolarHBondContact OD1-CB 3.46Å; N122-L124 PolarHBondContact OD1-N 3.2Å; L124-Q142 HydrophobicContact CD2-CG 4.44Å; L124-K148 HydrophobicContact CD2-CD 4.22Å; L124-K148 HydrophobicContact CD2-CG 3.75Å
125	T	77.9	Confident	76.1	Confident	37 Å²	37	65.5 Å²	65.5	23%	0.227	35%	0.351	C	S	.	.	S	Bend	trans	-83.6	157.1	180	-43	0	0	0	0	111.2	D118 N122 P123 Q142	D118-T125 HydrophobicContact CB-CG2 3.86Å; N122-T125 WeakPolarHBondContact CB-OG1 3.15Å; N122-T125 PolarHBondContact ND2-OG1 2.71Å; N122-T125 VanDerWaalsContact ND2-OG1 3.15Å; N122-T125 WeakPolarHBondContact O-CB 3.21Å; N122-T125 PolarHBondContact O-N 2.84Å; N122-T125 PolarHBondContact O-OG1 3.26Å; P123-T125 VanDerWaalsContact C-N 3.33Å; T125-Q142 PolarHBondContact O-NE2 3.4Å
126	N	73.4	Confident	76.9	Confident	118 Å²	118	65.8 Å²	65.8	63%	0.631	35%	0.345	S	S	*	.			trans	-65.8	149.5	-179.6	-150	21	0	0	0	111.7	D128	N126-D128 VanDerWaalsContact ND2-CG 3.31Å; N126-D128 PolarHBondContact ND2-OD1 2.88Å; N126-D128 VanDerWaalsContact ND2-OD1 3.07Å; N126-D128 PolarHBondContact ND2-OD2 2.92Å
127	L	74.7	Confident	77.6	Confident	13 Å²	13	64.9 Å²	64.9	7%	0.068	34%	0.339	C	S	.	.			trans	-110.5	34	-165.6	-60.1	174.9	0	0	0	113.4	W119 D129 Q135 L138 L139	W119-L127 HydrophobicContact CB-CD2 4.02Å; W119-L127 HydrophobicContact CG-CD2 4.26Å; L127-D129 VanDerWaalsContact C-N 3.25Å; L127-D129 PolarHBondContact O-N 3.19Å; L127-D129 VanDerWaalsContact O-N 3.1Å; L127-Q135 HydrophobicContact CB-CG 4.29Å; L127-Q135 PolarHBondContact O-NE2 2.67Å; L127-L138 HydrophobicContact CD1-CB 3.45Å; L127-L138 VanDerWaalsContact CD1-CB 3.45Å; L127-L138 HydrophobicContact CD1-CD1 4.38Å; L127-L138 HydrophobicContact CD2-CB 3.94Å; L127-L138 HydrophobicContact CD2-CD1 3.53Å; L127-L138 HydrophobicContact CD2-CG 4.25Å; L127-L138 HydrophobicContact CG-CB 4.34Å; L127-L139 HydrophobicContact CD1-CD2 4.38Å; L127-L139 HydrophobicContact CD1-CG 4.07Å
128	D	67.8	Low	78.4	Confident	120 Å²	120	63.7 Å²	63.7	64%	0.642	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.5	-26.5	-162.3	-65.6	-43.7	0	0	0	114.3	N126	N126-D128 VanDerWaalsContact ND2-CG 3.31Å; N126-D128 PolarHBondContact ND2-OD1 2.88Å; N126-D128 VanDerWaalsContact ND2-OD1 3.07Å; N126-D128 PolarHBondContact ND2-OD2 2.92Å
129	D	72.2	Confident	78.8	Confident	161 Å²	161	64.6 Å²	64.6	86%	0.861	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-117.6	9.3	-171.4	-64.5	-45.4	0	0	0	115.5	L127	L127-D129 VanDerWaalsContact C-N 3.25Å; L127-D129 PolarHBondContact O-N 3.19Å; L127-D129 VanDerWaalsContact O-N 3.1Å
130	E	74.5	Confident	79.2	Confident	48 Å²	48	69.9 Å²	69.9	22%	0.224	36%	0.36	C	S	.	.	S	Bend	trans	-89.5	156.5	-173.8	-68.2	-65.4	163.9	0	0	114.3	P117 W119 Q135	P117-E130 WeakPolarHBondContact CB-OE1 3.27Å; W119-E130 VanDerWaalsContact CD1-OE1 3.31Å; W119-E130 PolarHBondContact NE1-OE1 3.03Å; E130-Q135 HydrophobicContact CB-CG 3.82Å; E130-Q135 VanDerWaalsContact O-CD 3.3Å; E130-Q135 PolarHBondContact O-NE2 3.3Å
131	E	80.6	Confident	79.7	Confident	139 Å²	139	69.6 Å²	69.6	65%	0.65	36%	0.358	S	S	*	.			trans	-61.7	138	175.5	-173.2	168.3	-162.1	0	0	111.1	S133 L134 Q135	E131-S133 PolarHBondContact O-N 2.83Å; E131-S133 VanDerWaalsContact O-N 3.09Å; E131-L134 HydrophobicContact CB-CD1 4.28Å; E131-L134 HydrophobicContact CB-CG 4.45Å; E131-L134 WeakPolarHBondContact O-CA 3.42Å; E131-L134 WeakPolarHBondContact O-CB 3.34Å; E131-L134 PolarHBondContact O-N 2.91Å; E131-Q135 PolarHBondContact O-N 3.26Å
132	I	80.4	Confident	80.3	Confident	120 Å²	120	69.8 Å²	69.8	62%	0.615	36%	0.359	S	S	*	.	H	α-helix	trans	-51.9	-41.4	-172.3	-63.5	170.4	0	0	0	112.2	L134 Q135 E136	I132-L134 VanDerWaalsContact C-N 3.29Å; I132-L134 PolarHBondContact O-N 3.17Å; I132-Q135 WeakPolarHBondContact O-CB 3.12Å; I132-Q135 PolarHBondContact O-N 2.88Å; I132-E136 PolarHBondContact O-N 3.31Å; I132-E136 VanDerWaalsContact O-N 3.09Å
133	S	81.2	Confident	80.7	Confident	59 Å²	59	70.4 Å²	70.4	41%	0.413	37%	0.369	S	S	.	.	H	α-helix	trans	-66.2	-29.3	178.4	55.4	0	0	0	0	113.8	E131	E131-S133 PolarHBondContact O-N 2.83Å; E131-S133 VanDerWaalsContact O-N 3.09Å
134	L	84.8	Confident	81.5	Confident	17 Å²	17	72.7 Å²	72.7	9%	0.089	38%	0.381	C	S	.	.	H	α-helix	trans	-79	-38.9	173.8	-66.3	175.1	0	0	0	110.5	E131 I132 E136 Q137 L138 V171 V174	E131-L134 HydrophobicContact CB-CD1 4.28Å; E131-L134 HydrophobicContact CB-CG 4.45Å; E131-L134 WeakPolarHBondContact O-CA 3.42Å; E131-L134 WeakPolarHBondContact O-CB 3.34Å; E131-L134 PolarHBondContact O-N 2.91Å; I132-L134 VanDerWaalsContact C-N 3.29Å; I132-L134 PolarHBondContact O-N 3.17Å; L134-E136 VanDerWaalsContact C-N 3.32Å; L134-E136 PolarHBondContact O-N 2.94Å; L134-Q137 PolarHBondContact O-N 2.93Å; L134-L138 HydrophobicContact CB-CD1 4.47Å; L134-L138 WeakPolarHBondContact O-CB 3.32Å; L134-L138 VanDerWaalsContact O-CG 3.24Å; L134-L138 WeakPolarHBondContact O-CG 3.45Å; L134-L138 PolarHBondContact O-N 3.48Å; L134-V171 HydrophobicContact CD2-CG2 4.24Å; L134-V174 HydrophobicContact CD1-CG2 3.96Å; L134-V174 HydrophobicContact CD2-CG2 4.22Å
135	Q	85.4	Confident	82.1	Confident	54 Å²	54	74.7 Å²	74.7	25%	0.252	40%	0.396	S	S	.	.	H	α-helix	trans	-57.6	-43.3	176.7	-70.7	-179.3	-26.7	0	0	111.8	L127 E130 E131 I132 L138 L139	L127-Q135 HydrophobicContact CB-CG 4.29Å; L127-Q135 PolarHBondContact O-NE2 2.67Å; E130-Q135 HydrophobicContact CB-CG 3.82Å; E130-Q135 VanDerWaalsContact O-CD 3.3Å; E130-Q135 PolarHBondContact O-NE2 3.3Å; E131-Q135 PolarHBondContact O-N 3.26Å; I132-Q135 WeakPolarHBondContact O-CB 3.12Å; I132-Q135 PolarHBondContact O-N 2.88Å; Q135-L138 PolarHBondContact O-N 3.15Å; Q135-L139 VanDerWaalsContact O-CB 3.32Å; Q135-L139 WeakPolarHBondContact O-CB 3.33Å; Q135-L139 VanDerWaalsContact O-CG 3.24Å; Q135-L139 WeakPolarHBondContact O-CG 3.35Å; Q135-L139 PolarHBondContact O-N 3.19Å
136	E	88	Confident	82.4	Confident	132 Å²	132	79.3 Å²	79.3	62%	0.617	41%	0.414	S	S	*	.	H	α-helix	trans	-59.5	-49.3	176.9	-71.7	178.8	172.5	0	0	112.2	I132 L134 L138 L139 E140	I132-E136 PolarHBondContact O-N 3.31Å; I132-E136 VanDerWaalsContact O-N 3.09Å; L134-E136 VanDerWaalsContact C-N 3.32Å; L134-E136 PolarHBondContact O-N 2.94Å; E136-L138 VanDerWaalsContact C-N 3.34Å; E136-L138 PolarHBondContact O-N 3.36Å; E136-L139 PolarHBondContact O-N 2.83Å; E136-E140 PolarHBondContact O-N 2.98Å
137	Q	88.7	Confident	82.9	Confident	46 Å²	46	74 Å²	74	22%	0.215	39%	0.386	C	S	.	.	H	α-helix	trans	-64.8	-38.1	178.2	-72.2	-178.9	35.6	0	0	112.1	L134 L141 Y168 V171	L134-Q137 PolarHBondContact O-N 2.93Å; Q137-L141 VanDerWaalsContact O-CB 3.29Å; Q137-L141 WeakPolarHBondContact O-CB 3.44Å; Q137-L141 PolarHBondContact O-N 3.44Å; Q137-Y168 HydrophobicContact CB-CD1 4.09Å; Q137-Y168 WeakPolarHBondContact O-CD1 3.47Å; Q137-Y168 VanDerWaalsContact OE1-C 3.31Å; Q137-V171 HydrophobicContact CB-CG2 3.51Å
138	L	87.5	Confident	83.2	Confident	0 Å²	0	77.9 Å²	77.9	0%	0	40%	0.402	C	S	.	.	H	α-helix	trans	-70.3	-38.5	178.1	-72.6	168.4	0	0	0	111.6	W119 L127 L134 Q135 E136 L141 Q142 V171	W119-L138 HydrophobicContact CD2-CD1 3.77Å; W119-L138 HydrophobicContact CD2-CD2 3.9Å; W119-L138 HydrophobicContact CE3-CD1 4.26Å; W119-L138 HydrophobicContact CE3-CD2 3.56Å; W119-L138 HydrophobicContact CG-CD1 3.9Å; W119-L138 HydrophobicContact CG-CD2 4.34Å; W119-L138 HydrophobicContact CZ2-CD1 4.47Å; W119-L138 HydrophobicContact CZ3-CD2 4.08Å; L127-L138 HydrophobicContact CD1-CB 3.45Å; L127-L138 VanDerWaalsContact CD1-CB 3.45Å; L127-L138 HydrophobicContact CD1-CD1 4.38Å; L127-L138 HydrophobicContact CD2-CB 3.94Å; L127-L138 HydrophobicContact CD2-CD1 3.53Å; L127-L138 HydrophobicContact CD2-CG 4.25Å; L127-L138 HydrophobicContact CG-CB 4.34Å; L134-L138 HydrophobicContact CB-CD1 4.47Å; L134-L138 WeakPolarHBondContact O-CB 3.32Å; L134-L138 VanDerWaalsContact O-CG 3.24Å; L134-L138 WeakPolarHBondContact O-CG 3.45Å; L134-L138 PolarHBondContact O-N 3.48Å; Q135-L138 PolarHBondContact O-N 3.15Å; E136-L138 VanDerWaalsContact C-N 3.34Å; E136-L138 PolarHBondContact O-N 3.36Å; L138-L141 PolarHBondContact O-N 2.67Å; L138-Q142 VanDerWaalsContact O-CB 3.3Å; L138-Q142 WeakPolarHBondContact O-CB 3.33Å; L138-Q142 WeakPolarHBondContact O-CG 3.28Å; L138-Q142 PolarHBondContact O-N 3.29Å; L138-V171 HydrophobicContact CD2-CB 4.46Å; L138-V171 HydrophobicContact CD2-CG1 3.64Å; L138-V171 HydrophobicContact CD2-CG2 3.89Å; L138-V171 HydrophobicContact CG-CG1 4.39Å; L138-V171 HydrophobicContact CG-CG2 3.77Å
139	L	87.5	Confident	83.9	Confident	101 Å²	101	75.3 Å²	75.3	53%	0.529	40%	0.398	S	S	.	.	H	α-helix	trans	-64	-42.2	173.8	-77.4	167.4	0	0	0	111.5	L127 Q135 E136 Q142 S143	L127-L139 HydrophobicContact CD1-CD2 4.38Å; L127-L139 HydrophobicContact CD1-CG 4.07Å; Q135-L139 VanDerWaalsContact O-CB 3.32Å; Q135-L139 WeakPolarHBondContact O-CB 3.33Å; Q135-L139 VanDerWaalsContact O-CG 3.24Å; Q135-L139 WeakPolarHBondContact O-CG 3.35Å; Q135-L139 PolarHBondContact O-N 3.19Å; E136-L139 PolarHBondContact O-N 2.83Å; L139-Q142 CarbonylContact O-C 3.46Å; L139-Q142 PolarHBondContact O-N 2.85Å; L139-S143 WeakPolarHBondContact O-CB 3.43Å; L139-S143 PolarHBondContact O-N 3.38Å
140	E	88.6	Confident	84.2	Confident	116 Å²	116	71.7 Å²	71.7	54%	0.542	37%	0.372	S	S	.	.	H	α-helix	trans	-63.2	-45.4	174.8	-174	177.1	-165.3	0	0	111	E136 Q142 S143 N144 Y168	E136-E140 PolarHBondContact O-N 2.98Å; E140-Q142 VanDerWaalsContact C-N 3.3Å; E140-Q142 PolarHBondContact O-N 3.22Å; E140-S143 PolarHBondContact O-N 3.49Å; E140-S143 PolarHBondContact O-OG 3.43Å; E140-N144 PolarHBondContact O-N 2.9Å; E140-N144 VanDerWaalsContact O-N 3.15Å; E140-Y168 HydrophobicContact CB-CE1 4.04Å; E140-Y168 HydrophobicContact CG-CE1 4Å
141	L	86.7	Confident	84.1	Confident	2 Å²	2	70.3 Å²	70.3	1%	0.01	37%	0.368	C	S	.	.	H	α-helix	trans	-59	-41.2	174.1	-177.1	152.8	0	0	0	111.8	P123 Q137 L138 S143 N144 L147 F158 W159 V164 Y168	P123-L141 HydrophobicContact CB-CD2 3.56Å; Q137-L141 VanDerWaalsContact O-CB 3.29Å; Q137-L141 WeakPolarHBondContact O-CB 3.44Å; Q137-L141 PolarHBondContact O-N 3.44Å; L138-L141 PolarHBondContact O-N 2.67Å; L141-S143 VanDerWaalsContact C-N 3.29Å; L141-S143 PolarHBondContact O-N 3.36Å; L141-N144 PolarHBondContact O-N 2.75Å; L141-L147 HydrophobicContact CG-CD1 4.43Å; L141-F158 HydrophobicContact CD1-CE1 4.19Å; L141-F158 HydrophobicContact CD1-CZ 3.99Å; L141-F158 HydrophobicContact CD2-CE1 4.41Å; L141-F158 HydrophobicContact CD2-CZ 3.92Å; L141-F158 HydrophobicContact CG-CZ 4.16Å; L141-W159 HydrophobicContact CD1-CH2 4.1Å; L141-W159 HydrophobicContact CD1-CZ3 3.98Å; L141-V164 HydrophobicContact CD1-CG1 4.36Å; L141-Y168 HydrophobicContact CB-CD1 4.31Å; L141-Y168 HydrophobicContact CB-CE1 3.98Å; L141-Y168 HydrophobicContact CB-CE2 4.25Å; L141-Y168 HydrophobicContact CD1-CD2 3.96Å; L141-Y168 HydrophobicContact CD1-CE2 4.21Å; L141-Y168 HydrophobicContact CD1-CG 4.24Å; L141-Y168 HydrophobicContact CG-CE2 4.38Å
142	Q	84.9	Confident	83.9	Confident	36 Å²	36	68.6 Å²	68.6	17%	0.168	37%	0.371	C	S	.	.	H	α-helix	trans	-73.2	-14.8	174.5	-74.2	179.1	12	0	0	113.5	P123 L124 T125 L138 L139 E140 K148	P123-Q142 WeakPolarHBondContact O-CG 3.49Å; P123-Q142 PolarHBondContact O-NE2 3.14Å; L124-Q142 HydrophobicContact CD2-CG 4.44Å; T125-Q142 PolarHBondContact O-NE2 3.4Å; L138-Q142 VanDerWaalsContact O-CB 3.3Å; L138-Q142 WeakPolarHBondContact O-CB 3.33Å; L138-Q142 WeakPolarHBondContact O-CG 3.28Å; L138-Q142 PolarHBondContact O-N 3.29Å; L139-Q142 CarbonylContact O-C 3.46Å; L139-Q142 PolarHBondContact O-N 2.85Å; E140-Q142 VanDerWaalsContact C-N 3.3Å; E140-Q142 PolarHBondContact O-N 3.22Å; Q142-K148 WeakPolarHBondContact O-CE 3.42Å; Q142-K148 PolarHBondContact O-NZ 2.73Å
143	S	85.8	Confident	83.6	Confident	82 Å²	82	69.5 Å²	69.5	57%	0.573	37%	0.373	S	S	*	.	H	α-helix	trans	-87	-22.9	173.5	77.4	0	0	0	0	111.7	L139 E140 L141 V145	L139-S143 WeakPolarHBondContact O-CB 3.43Å; L139-S143 PolarHBondContact O-N 3.38Å; E140-S143 PolarHBondContact O-N 3.49Å; E140-S143 PolarHBondContact O-OG 3.43Å; L141-S143 VanDerWaalsContact C-N 3.29Å; L141-S143 PolarHBondContact O-N 3.36Å; S143-V145 PolarHBondContact O-N 3.03Å
144	N	87.1	Confident	83	Confident	52 Å²	52	68.1 Å²	68.1	28%	0.278	37%	0.367	S	S	.	.			trans	-76	108.1	-175.6	-169.9	-47.5	0	0	0	112.2	E140 L141 E146 L147 K148	E140-N144 PolarHBondContact O-N 2.9Å; E140-N144 VanDerWaalsContact O-N 3.15Å; L141-N144 PolarHBondContact O-N 2.75Å; N144-E146 VanDerWaalsContact C-N 3.33Å; N144-E146 PolarHBondContact O-N 2.84Å; N144-E146 PolarHBondContact OD1-N 3.25Å; N144-E146 VanDerWaalsContact OD1-N 3.08Å; N144-L147 HydrophobicContact CB-CB 4.11Å; N144-L147 HydrophobicContact CB-CD1 3.99Å; N144-L147 HydrophobicContact CB-CG 4.17Å; N144-L147 PolarHBondContact O-N 2.84Å; N144-L147 PolarHBondContact OD1-N 2.8Å; N144-L147 VanDerWaalsContact OD1-N 3.09Å; N144-K148 WeakPolarHBondContact O-CG 3.4Å; N144-K148 PolarHBondContact O-N 3.39Å
145	V	85.7	Confident	82.4	Confident	116 Å²	116	71.5 Å²	71.5	70%	0.703	38%	0.38	S	S	*	.	H	α-helix	trans	-63	-36.3	-176.8	-178.4	0	0	0	0	112.5	S143 K148 A149	S143-V145 PolarHBondContact O-N 3.03Å; V145-K148 PolarHBondContact O-N 3.27Å; V145-A149 PolarHBondContact O-N 2.82Å
146	E	85.9	Confident	81.6	Confident	133 Å²	133	72.4 Å²	72.4	62%	0.621	38%	0.384	S	S	*	.	H	α-helix	trans	-69.2	-42	179.6	-63.5	-170.6	168.8	0	0	111.6	N144 A149 R150	N144-E146 VanDerWaalsContact C-N 3.33Å; N144-E146 PolarHBondContact O-N 2.84Å; N144-E146 PolarHBondContact OD1-N 3.25Å; N144-E146 VanDerWaalsContact OD1-N 3.08Å; E146-A149 PolarHBondContact O-N 3.38Å; E146-R150 WeakPolarHBondContact O-CG 3.36Å; E146-R150 PolarHBondContact O-N 2.82Å
147	L	83.2	Confident	81	Confident	7 Å²	7	68.9 Å²	68.9	4%	0.037	37%	0.373	C	S	.	.	H	α-helix	trans	-67.3	-36.9	176.8	-67.4	179.5	0	0	0	111.9	L141 N144 A149 R150 S151 F158 V164 Y168	L141-L147 HydrophobicContact CG-CD1 4.43Å; N144-L147 HydrophobicContact CB-CB 4.11Å; N144-L147 HydrophobicContact CB-CD1 3.99Å; N144-L147 HydrophobicContact CB-CG 4.17Å; N144-L147 PolarHBondContact O-N 2.84Å; N144-L147 PolarHBondContact OD1-N 2.8Å; N144-L147 VanDerWaalsContact OD1-N 3.09Å; L147-A149 VanDerWaalsContact C-N 3.32Å; L147-A149 PolarHBondContact O-N 3.36Å; L147-R150 PolarHBondContact O-N 3.45Å; L147-S151 PolarHBondContact O-N 2.8Å; L147-F158 HydrophobicContact CB-CE2 4.11Å; L147-F158 HydrophobicContact CD2-CE2 4.4Å; L147-V164 HydrophobicContact CD1-CG2 4.46Å; L147-V164 HydrophobicContact CD2-CG2 3.82Å; L147-Y168 HydrophobicContact CD1-CE2 3.6Å
148	K	81.8	Confident	80.4	Confident	94 Å²	94	66.8 Å²	66.8	41%	0.409	36%	0.363	S	S	.	.	H	α-helix	trans	-57.2	-44.4	171.1	-75.5	-165.7	179	165.8	0	112.6	L124 Q142 N144 V145 R150 S151	L124-K148 HydrophobicContact CD2-CD 4.22Å; L124-K148 HydrophobicContact CD2-CG 3.75Å; Q142-K148 WeakPolarHBondContact O-CE 3.42Å; Q142-K148 PolarHBondContact O-NZ 2.73Å; N144-K148 WeakPolarHBondContact O-CG 3.4Å; N144-K148 PolarHBondContact O-N 3.39Å; V145-K148 PolarHBondContact O-N 3.27Å; K148-R150 VanDerWaalsContact C-N 3.28Å; K148-R150 PolarHBondContact O-N 2.92Å; K148-S151 PolarHBondContact O-N 3.19Å; K148-S151 PolarHBondContact O-OG 3.44Å
149	A	81	Confident	80.1	Confident	66 Å²	66	66.9 Å²	66.9	55%	0.545	36%	0.363	S	S	.	.	H	α-helix	trans	-63.9	-38.9	179.5	0	0	0	0	0	111	V145 E146 L147 S152	V145-A149 PolarHBondContact O-N 2.82Å; E146-A149 PolarHBondContact O-N 3.38Å; L147-A149 VanDerWaalsContact C-N 3.32Å; L147-A149 PolarHBondContact O-N 3.36Å; A149-S152 WeakPolarHBondContact O-CB 3.3Å; A149-S152 PolarHBondContact O-OG 3.38Å
150	R	78.5	Confident	79.8	Confident	85 Å²	85	67 Å²	67	32%	0.321	36%	0.364	S	S	.	.	H	α-helix	trans	-74.5	-27.2	179.9	-66.2	-178.5	-173.3	-179.2	7.3	114	E146 L147 K148 S152 Q153 Q161 E163	E146-R150 WeakPolarHBondContact O-CG 3.36Å; E146-R150 PolarHBondContact O-N 2.82Å; L147-R150 PolarHBondContact O-N 3.45Å; K148-R150 VanDerWaalsContact C-N 3.28Å; K148-R150 PolarHBondContact O-N 2.92Å; R150-S152 PolarHBondContact O-N 3.35Å; R150-S152 VanDerWaalsContact O-N 3.17Å; R150-Q153 WeakPolarHBondContact O-CB 3.09Å; R150-Q153 PolarHBondContact O-N 2.71Å; R150-Q161 VanDerWaalsContact NH1-OE1 3.14Å; R150-E163 IonicContact CZ-OE2 2.68Å; R150-E163 IonicContact NH1-OE1 2.72Å; R150-E163 IonicContact NH1-OE2 3.82Å; R150-E163 PolarHBondContact NH1-OE2 3.39Å; R150-E163 IonicContact NH2-OE2 3.81Å
151	S	72.8	Confident	79.4	Confident	20 Å²	20	62.8 Å²	62.8	14%	0.14	34%	0.344	C	S	.	.	H	α-helix	trans	-62.7	-21.6	177.5	74.5	0	0	0	0	112.8	L147 K148 Q153 G154	L147-S151 PolarHBondContact O-N 2.8Å; K148-S151 PolarHBondContact O-N 3.19Å; K148-S151 PolarHBondContact O-OG 3.44Å; S151-Q153 PolarHBondContact O-N 3.35Å; S151-G154 PolarHBondContact O-N 3.08Å
152	S	75.9	Confident	79.4	Confident	102 Å²	102	71.5 Å²	71.5	71%	0.713	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.3	-20.9	172.5	70.5	0	0	0	0	114.3	A149 R150 G154	A149-S152 WeakPolarHBondContact O-CB 3.3Å; A149-S152 PolarHBondContact O-OG 3.38Å; R150-S152 PolarHBondContact O-N 3.35Å; R150-S152 VanDerWaalsContact O-N 3.17Å; S152-G154 PolarHBondContact O-N 2.9Å
153	Q	75.2	Confident	79.4	Confident	140 Å²	140	74.6 Å²	74.6	65%	0.654	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.3	-6.3	175.4	-61.8	-177.2	-9.3	0	0	113.1	R150 S151 P157	R150-Q153 WeakPolarHBondContact O-CB 3.09Å; R150-Q153 PolarHBondContact O-N 2.71Å; S151-Q153 PolarHBondContact O-N 3.35Å; Q153-P157 HydrophobicContact CB-CG 4.27Å; Q153-P157 WeakPolarHBondContact O-CG 3.47Å
154	G	69.1	Low	79.3	Confident	29 Å²	29	70.7 Å²	70.7	30%	0.299	37%	0.369	S	S	.	.			trans	104.4	158	-178.1	0	0	0	0	0	113.2	S151 S152 Q156 P157 F158	S151-G154 PolarHBondContact O-N 3.08Å; S152-G154 PolarHBondContact O-N 2.9Å; G154-Q156 PolarHBondContact O-N 2.73Å; G154-P157 VanDerWaalsContact O-CD 3.31Å; G154-P157 WeakPolarHBondContact O-CD 3.43Å; G154-P157 WeakPolarHBondContact O-CG 3.43Å; G154-F158 VanDerWaalsContact O-CB 3.26Å; G154-F158 WeakPolarHBondContact O-CB 3.14Å; G154-F158 PolarHBondContact O-N 3.31Å
155	Y	70.4	Confident	79.2	Confident	88 Å²	88	71 Å²	71	35%	0.345	37%	0.369	S	S	.	.	H	α-helix	trans	-67.5	-37.6	-172.1	68.4	-86.8	0	0	0	113.9	I121 F158 W159	I121-Y155 HydrophobicContact CG2-CD1 4.23Å; Y155-F158 WeakPolarHBondContact O-CB 3.12Å; Y155-F158 PolarHBondContact O-N 3.3Å; Y155-W159 PolarHBondContact O-N 3.06Å
156	Q	69.4	Low	79.2	Confident	74 Å²	74	68.2 Å²	68.2	35%	0.346	36%	0.364	S	S	.	.	H	α-helix	trans	-57.9	-59.4	179.2	-71.8	-77	-34.4	0	0	112.4	G154 F158 W159 L160	G154-Q156 PolarHBondContact O-N 2.73Å; Q156-F158 PolarHBondContact O-N 2.91Å; Q156-W159 PolarHBondContact O-N 2.99Å; Q156-L160 VanDerWaalsContact O-CG 3.32Å; Q156-L160 WeakPolarHBondContact O-CG 3.43Å; Q156-L160 PolarHBondContact O-N 3.17Å
157	P	74.3	Confident	79.2	Confident	58 Å²	58	67.6 Å²	67.6	38%	0.377	36%	0.364	S	S	.	.	H	α-helix	trans	-65.6	-29.4	178.1	26.2	-34.2	0	0	0	112.3	Q153 G154 L160 Q161	Q153-P157 HydrophobicContact CB-CG 4.27Å; Q153-P157 WeakPolarHBondContact O-CG 3.47Å; G154-P157 VanDerWaalsContact O-CD 3.31Å; G154-P157 WeakPolarHBondContact O-CD 3.43Å; G154-P157 WeakPolarHBondContact O-CG 3.43Å; P157-L160 PolarHBondContact O-N 3.26Å; P157-Q161 WeakPolarHBondContact O-CG 3.17Å
158	F	78	Confident	79.5	Confident	2 Å²	2	67.4 Å²	67.4	1%	0.009	36%	0.363	C	S	.	.	H	α-helix	trans	-60	-52.4	176.6	176	-99.3	0	0	0	112.2	P123 L141 L147 G154 Y155 Q156 L160 Q161 V164	P123-F158 HydrophobicContact CB-CE1 4.14Å; P123-F158 HydrophobicContact CB-CZ 4.43Å; P123-F158 HydrophobicContact CG-CD1 3.85Å; P123-F158 HydrophobicContact CG-CE1 3.51Å; P123-F158 HydrophobicContact CG-CZ 4.12Å; L141-F158 HydrophobicContact CD1-CE1 4.19Å; L141-F158 HydrophobicContact CD1-CZ 3.99Å; L141-F158 HydrophobicContact CD2-CE1 4.41Å; L141-F158 HydrophobicContact CD2-CZ 3.92Å; L141-F158 HydrophobicContact CG-CZ 4.16Å; L147-F158 HydrophobicContact CB-CE2 4.11Å; L147-F158 HydrophobicContact CD2-CE2 4.4Å; G154-F158 VanDerWaalsContact O-CB 3.26Å; G154-F158 WeakPolarHBondContact O-CB 3.14Å; G154-F158 PolarHBondContact O-N 3.31Å; Y155-F158 WeakPolarHBondContact O-CB 3.12Å; Y155-F158 PolarHBondContact O-N 3.3Å; Q156-F158 PolarHBondContact O-N 2.91Å; F158-L160 VanDerWaalsContact C-N 3.31Å; F158-L160 PolarHBondContact O-N 3.4Å; F158-Q161 WeakPolarHBondContact O-CB 3.18Å; F158-Q161 WeakPolarHBondContact O-CG 3.34Å; F158-Q161 PolarHBondContact O-N 2.87Å; F158-V164 HydrophobicContact CE2-CG2 4.49Å; F158-V164 HydrophobicContact CZ-CG2 4.36Å
159	W	80.8	Confident	79.7	Confident	1 Å²	1	66.8 Å²	66.8	0%	0.004	37%	0.371	C	S	.	.	H	α-helix	trans	-73.8	-21	-178	-63.8	121.2	0	0	0	114	W119 V120 P123 L141 Y155 Q156 Q161 V164 Q165 V171 W172 V175	W119-W159 AromaticContact CE3-CH2 3.96Å; W119-W159 HydrophobicContact CE3-CH2 3.96Å; W119-W159 AromaticContact CE3-CZ2 3.89Å; W119-W159 HydrophobicContact CE3-CZ2 3.89Å; W119-W159 AromaticContact CZ3-CH2 3.7Å; W119-W159 HydrophobicContact CZ3-CH2 3.7Å; W119-W159 AromaticContact CZ3-CZ2 3.81Å; W119-W159 HydrophobicContact CZ3-CZ2 3.81Å; V120-W159 PolarHBondContact O-NE1 2.76Å; P123-W159 HydrophobicContact CB-CZ2 4.38Å; P123-W159 HydrophobicContact CG-CH2 4.43Å; P123-W159 HydrophobicContact CG-CZ2 3.84Å; L141-W159 HydrophobicContact CD1-CH2 4.1Å; L141-W159 HydrophobicContact CD1-CZ3 3.98Å; Y155-W159 PolarHBondContact O-N 3.06Å; Q156-W159 PolarHBondContact O-N 2.99Å; W159-Q161 PolarHBondContact O-N 3.36Å; W159-V164 HydrophobicContact CE3-CG1 3.68Å; W159-V164 HydrophobicContact CZ3-CG1 3.82Å; W159-Q165 PolarHBondContact O-NE2 2.91Å; W159-V171 HydrophobicContact CH2-CG1 3.47Å; W159-V171 VanDerWaalsContact CH2-CG1 3.47Å; W159-V171 HydrophobicContact CZ3-CG1 3.52Å; W159-W172 HydrophobicContact CB-CE3 4.21Å; W159-W172 HydrophobicContact CB-CZ3 3.74Å; W159-W172 VanDerWaalsContact O-CZ3 3.23Å; W159-W172 WeakPolarHBondContact O-CZ3 3.21Å; W159-V175 HydrophobicContact CB-CG1 3.85Å; W159-V175 HydrophobicContact CD2-CB 4.36Å; W159-V175 HydrophobicContact CD2-CG1 3.87Å; W159-V175 HydrophobicContact CD2-CG2 3.82Å; W159-V175 HydrophobicContact CE3-CG1 4.41Å; W159-V175 HydrophobicContact CE3-CG2 3.93Å; W159-V175 HydrophobicContact CG-CG1 3.61Å; W159-V175 HydrophobicContact CG-CG2 4.43Å; W159-V175 HydrophobicContact CH2-CG2 4.06Å; W159-V175 HydrophobicContact CZ2-CG2 3.92Å; W159-V175 HydrophobicContact CZ3-CG2 4.06Å
160	L	79.7	Confident	80	Confident	103 Å²	103	64.9 Å²	64.9	54%	0.539	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.9	-0.1	176.6	-68.9	174	0	0	0	113.7	Q156 P157 F158 Q165 W172	Q156-L160 VanDerWaalsContact O-CG 3.32Å; Q156-L160 WeakPolarHBondContact O-CG 3.43Å; Q156-L160 PolarHBondContact O-N 3.17Å; P157-L160 PolarHBondContact O-N 3.26Å; F158-L160 VanDerWaalsContact C-N 3.31Å; F158-L160 PolarHBondContact O-N 3.4Å; L160-Q165 PolarHBondContact O-NE2 3.25Å; L160-W172 HydrophobicContact CD2-CH2 4.28Å
161	Q	81.8	Confident	80.4	Confident	29 Å²	29	60.9 Å²	60.9	14%	0.136	34%	0.342	C	S	.	.			trans	-72.8	128.5	176.7	-64.1	179.3	22.6	0	0	111.3	R150 P157 F158 W159 E163 V164 Q165	R150-Q161 VanDerWaalsContact NH1-OE1 3.14Å; P157-Q161 WeakPolarHBondContact O-CG 3.17Å; F158-Q161 WeakPolarHBondContact O-CB 3.18Å; F158-Q161 WeakPolarHBondContact O-CG 3.34Å; F158-Q161 PolarHBondContact O-N 2.87Å; W159-Q161 PolarHBondContact O-N 3.36Å; Q161-E163 PolarHBondContact O-N 2.89Å; Q161-V164 HydrophobicContact CB-CB 4.44Å; Q161-V164 HydrophobicContact CB-CG2 4.09Å; Q161-V164 PolarHBondContact O-N 3.15Å; Q161-V164 VanDerWaalsContact O-N 3.13Å; Q161-Q165 WeakPolarHBondContact O-CG 3.41Å; Q161-Q165 PolarHBondContact O-N 2.68Å; Q161-Q165 VanDerWaalsContact O-N 3.13Å
162	K	86.5	Confident	81.1	Confident	184 Å²	184	61.7 Å²	61.7	80%	0.8	34%	0.342	S	S	*	.	H	α-helix	trans	-56.4	-34.4	178.1	-72.3	-173.8	176.8	-179.6	0	113.2	Q165 G166	K162-Q165 PolarHBondContact O-N 3.33Å; K162-G166 PolarHBondContact O-N 2.98Å; K162-G166 VanDerWaalsContact O-N 3.12Å
163	E	85.2	Confident	81.5	Confident	101 Å²	101	58.1 Å²	58.1	47%	0.472	32%	0.322	S	S	.	.	H	α-helix	trans	-60.9	-49.3	177.5	-68.3	163.2	-167.7	0	0	111.2	R150 Q161 Q165 G166 L167	R150-E163 IonicContact CZ-OE2 2.68Å; R150-E163 IonicContact NH1-OE1 2.72Å; R150-E163 IonicContact NH1-OE2 3.82Å; R150-E163 PolarHBondContact NH1-OE2 3.39Å; R150-E163 IonicContact NH2-OE2 3.81Å; Q161-E163 PolarHBondContact O-N 2.89Å; E163-Q165 PolarHBondContact O-N 2.89Å; E163-G166 PolarHBondContact O-N 3.32Å; E163-L167 WeakPolarHBondContact O-CB 3.4Å; E163-L167 WeakPolarHBondContact O-CG 3.49Å; E163-L167 PolarHBondContact O-N 3.09Å
164	V	82.9	Confident	81.8	Confident	0 Å²	0	53.6 Å²	53.6	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-65.1	-41.3	179.7	179.1	0	0	0	0	110.9	L141 L147 F158 W159 Q161 G166 Y168	L141-V164 HydrophobicContact CD1-CG1 4.36Å; L147-V164 HydrophobicContact CD1-CG2 4.46Å; L147-V164 HydrophobicContact CD2-CG2 3.82Å; F158-V164 HydrophobicContact CE2-CG2 4.49Å; F158-V164 HydrophobicContact CZ-CG2 4.36Å; W159-V164 HydrophobicContact CE3-CG1 3.68Å; W159-V164 HydrophobicContact CZ3-CG1 3.82Å; Q161-V164 HydrophobicContact CB-CB 4.44Å; Q161-V164 HydrophobicContact CB-CG2 4.09Å; Q161-V164 PolarHBondContact O-N 3.15Å; Q161-V164 VanDerWaalsContact O-N 3.13Å; V164-G166 VanDerWaalsContact C-N 3.3Å; V164-G166 PolarHBondContact O-N 2.93Å; V164-Y168 HydrophobicContact CG1-CD2 4.13Å; V164-Y168 PolarHBondContact O-N 3.24Å
165	Q	84.3	Confident	82.2	Confident	58 Å²	58	52.2 Å²	52.2	27%	0.271	29%	0.289	S	S	.	.	H	α-helix	trans	-64.2	-33.6	-179.6	-63.9	179.8	6.8	0	0	113.4	W159 L160 Q161 K162 E163 W172	W159-Q165 PolarHBondContact O-NE2 2.91Å; L160-Q165 PolarHBondContact O-NE2 3.25Å; Q161-Q165 WeakPolarHBondContact O-CG 3.41Å; Q161-Q165 PolarHBondContact O-N 2.68Å; Q161-Q165 VanDerWaalsContact O-N 3.13Å; K162-Q165 PolarHBondContact O-N 3.33Å; E163-Q165 PolarHBondContact O-N 2.89Å; Q165-W172 HydrophobicContact CB-CD2 4.39Å; Q165-W172 HydrophobicContact CB-CG 4.15Å; Q165-W172 HydrophobicContact CG-CD2 3.7Å; Q165-W172 VanDerWaalsContact CG-CE2 3.47Å; Q165-W172 HydrophobicContact CG-CE3 4.27Å; Q165-W172 HydrophobicContact CG-CG 3.98Å; Q165-W172 HydrophobicContact CG-CH2 4.42Å; Q165-W172 HydrophobicContact CG-CZ2 3.86Å; Q165-W172 VanDerWaalsContact NE2-CZ2 3.34Å
166	G	86.6	Confident	82.6	Confident	59 Å²	59	52.9 Å²	52.9	61%	0.608	29%	0.294	S	S	*	.	H	α-helix	trans	-83.3	-45.7	179.7	0	0	0	0	0	113.2	K162 E163 V164	K162-G166 PolarHBondContact O-N 2.98Å; K162-G166 VanDerWaalsContact O-N 3.12Å; E163-G166 PolarHBondContact O-N 3.32Å; V164-G166 VanDerWaalsContact C-N 3.3Å; V164-G166 PolarHBondContact O-N 2.93Å
167	L	86.7	Confident	82.8	Confident	119 Å²	119	54.4 Å²	54.4	62%	0.623	30%	0.304	S	S	*	.	H	α-helix	trans	-73.9	-41	-175.6	-66.9	173.4	0	0	0	112.3	E163	E163-L167 WeakPolarHBondContact O-CB 3.4Å; E163-L167 WeakPolarHBondContact O-CG 3.49Å; E163-L167 PolarHBondContact O-N 3.09Å
168	Y	87.8	Confident	82.5	Confident	4 Å²	4	52.6 Å²	52.6	2%	0.016	29%	0.291	C	S	.	.			trans	-114.1	59.7	-173.9	-48.3	-75.6	0	0	0	110.5	Q137 E140 L141 L147 V164 G170 V171 W172	Q137-Y168 HydrophobicContact CB-CD1 4.09Å; Q137-Y168 WeakPolarHBondContact O-CD1 3.47Å; Q137-Y168 VanDerWaalsContact OE1-C 3.31Å; E140-Y168 HydrophobicContact CB-CE1 4.04Å; E140-Y168 HydrophobicContact CG-CE1 4Å; L141-Y168 HydrophobicContact CB-CD1 4.31Å; L141-Y168 HydrophobicContact CB-CE1 3.98Å; L141-Y168 HydrophobicContact CB-CE2 4.25Å; L141-Y168 HydrophobicContact CD1-CD2 3.96Å; L141-Y168 HydrophobicContact CD1-CE2 4.21Å; L141-Y168 HydrophobicContact CD1-CG 4.24Å; L141-Y168 HydrophobicContact CG-CE2 4.38Å; L147-Y168 HydrophobicContact CD1-CE2 3.6Å; V164-Y168 HydrophobicContact CG1-CD2 4.13Å; V164-Y168 PolarHBondContact O-N 3.24Å; Y168-G170 VanDerWaalsContact C-N 3.26Å; Y168-G170 PolarHBondContact O-N 3.21Å; Y168-V171 PolarHBondContact O-N 3.14Å; Y168-W172 VanDerWaalsContact O-CB 3.27Å; Y168-W172 WeakPolarHBondContact O-CB 3.35Å; Y168-W172 PolarHBondContact O-N 3.14Å
169	S	86.6	Confident	81.9	Confident	81 Å²	81	54 Å²	54	57%	0.566	30%	0.299	S	S	*	.	H	α-helix	trans	-60.5	-32.1	-173.9	64.5	0	0	0	0	113.9	G173	S169-G173 PolarHBondContact O-N 3.49Å
170	G	87.7	Confident	81	Confident	26 Å²	26	58.8 Å²	58.8	27%	0.268	32%	0.323	S	S	.	.	H	α-helix	trans	-69.9	-51.9	177.8	0	0	0	0	0	111.5	Y168 W172 G173 V174	Y168-G170 VanDerWaalsContact C-N 3.26Å; Y168-G170 PolarHBondContact O-N 3.21Å; G170-W172 PolarHBondContact O-N 2.7Å; G170-G173 WeakPolarHBondContact O-CA 3.43Å; G170-G173 PolarHBondContact O-N 3.33Å; G170-G173 VanDerWaalsContact O-N 3.09Å; G170-V174 PolarHBondContact O-N 3.3Å
171	V	86.2	Confident	79.9	Confident	0 Å²	0	56.2 Å²	56.2	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-59	-47.4	176	179	0	0	0	0	110.8	W119 L134 Q137 L138 W159 Y168 G173 V174 V175	W119-V171 HydrophobicContact CE3-CG1 4.1Å; W119-V171 HydrophobicContact CH2-CG1 3.7Å; W119-V171 HydrophobicContact CZ3-CG1 3.3Å; L134-V171 HydrophobicContact CD2-CG2 4.24Å; Q137-V171 HydrophobicContact CB-CG2 3.51Å; L138-V171 HydrophobicContact CD2-CB 4.46Å; L138-V171 HydrophobicContact CD2-CG1 3.64Å; L138-V171 HydrophobicContact CD2-CG2 3.89Å; L138-V171 HydrophobicContact CG-CG1 4.39Å; L138-V171 HydrophobicContact CG-CG2 3.77Å; W159-V171 HydrophobicContact CH2-CG1 3.47Å; W159-V171 VanDerWaalsContact CH2-CG1 3.47Å; W159-V171 HydrophobicContact CZ3-CG1 3.52Å; Y168-V171 PolarHBondContact O-N 3.14Å; V171-G173 VanDerWaalsContact C-N 3.26Å; V171-G173 PolarHBondContact O-N 3.01Å; V171-V174 PolarHBondContact O-N 3Å; V171-V175 HydrophobicContact CG1-CG2 4.5Å; V171-V175 WeakPolarHBondContact O-CG2 3.36Å; V171-V175 PolarHBondContact O-N 3.36Å
172	W	86.9	Confident	78.4	Confident	38 Å²	38	58 Å²	58	14%	0.144	32%	0.323	C	S	.	.	H	α-helix	trans	-62.2	-33.6	176.4	175.7	-125.3	0	0	0	112.3	W159 L160 Q165 Y168 G170 V174 V175 K176 L179	W159-W172 HydrophobicContact CB-CE3 4.21Å; W159-W172 HydrophobicContact CB-CZ3 3.74Å; W159-W172 VanDerWaalsContact O-CZ3 3.23Å; W159-W172 WeakPolarHBondContact O-CZ3 3.21Å; L160-W172 HydrophobicContact CD2-CH2 4.28Å; Q165-W172 HydrophobicContact CB-CD2 4.39Å; Q165-W172 HydrophobicContact CB-CG 4.15Å; Q165-W172 HydrophobicContact CG-CD2 3.7Å; Q165-W172 VanDerWaalsContact CG-CE2 3.47Å; Q165-W172 HydrophobicContact CG-CE3 4.27Å; Q165-W172 HydrophobicContact CG-CG 3.98Å; Q165-W172 HydrophobicContact CG-CH2 4.42Å; Q165-W172 HydrophobicContact CG-CZ2 3.86Å; Q165-W172 VanDerWaalsContact NE2-CZ2 3.34Å; Y168-W172 VanDerWaalsContact O-CB 3.27Å; Y168-W172 WeakPolarHBondContact O-CB 3.35Å; Y168-W172 PolarHBondContact O-N 3.14Å; G170-W172 PolarHBondContact O-N 2.7Å; W172-V174 VanDerWaalsContact C-N 3.34Å; W172-V174 PolarHBondContact O-N 3.22Å; W172-V175 HydrophobicContact CE3-CB 3.97Å; W172-V175 HydrophobicContact CE3-CG1 3.92Å; W172-V175 HydrophobicContact CZ3-CB 4.31Å; W172-V175 HydrophobicContact CZ3-CG1 3.77Å; W172-V175 PolarHBondContact O-N 3.04Å; W172-K176 HydrophobicContact CD2-CB 4.3Å; W172-K176 HydrophobicContact CZ2-CB 4.27Å; W172-K176 HydrophobicContact CZ2-CG 4.46Å; W172-K176 WeakPolarHBondContact O-CA 3.44Å; W172-K176 WeakPolarHBondContact O-CB 3.14Å; W172-K176 PolarHBondContact O-N 2.88Å; W172-L179 HydrophobicContact CH2-CD1 3.94Å; W172-L179 HydrophobicContact CZ3-CD1 3.76Å
173	G	85.5	Confident	76.6	Confident	27 Å²	27	51.6 Å²	51.6	28%	0.278	30%	0.301	S	S	.	.	H	α-helix	trans	-57.2	-46.3	173.9	0	0	0	0	0	112.5	S169 G170 V171 N177	S169-G173 PolarHBondContact O-N 3.49Å; G170-G173 WeakPolarHBondContact O-CA 3.43Å; G170-G173 PolarHBondContact O-N 3.33Å; G170-G173 VanDerWaalsContact O-N 3.09Å; V171-G173 VanDerWaalsContact C-N 3.26Å; V171-G173 PolarHBondContact O-N 3.01Å; G173-N177 VanDerWaalsContact O-CG 3.28Å; G173-N177 PolarHBondContact O-N 3.32Å; G173-N177 VanDerWaalsContact O-N 3.15Å; G173-N177 PolarHBondContact O-ND2 3.24Å
174	V	80.3	Confident	74.8	Confident	44 Å²	44	49 Å²	49	27%	0.267	29%	0.294	S	S	.	.	H	α-helix	trans	-65.5	-50.4	176.5	178.9	0	0	0	0	110.8	W119 L134 G170 V171 W172 K176 N177 L178	W119-V174 HydrophobicContact CH2-CB 4Å; W119-V174 HydrophobicContact CH2-CG1 3.99Å; W119-V174 HydrophobicContact CZ2-CB 4.23Å; W119-V174 HydrophobicContact CZ2-CG1 3.87Å; L134-V174 HydrophobicContact CD1-CG2 3.96Å; L134-V174 HydrophobicContact CD2-CG2 4.22Å; G170-V174 PolarHBondContact O-N 3.3Å; V171-V174 PolarHBondContact O-N 3Å; W172-V174 VanDerWaalsContact C-N 3.34Å; W172-V174 PolarHBondContact O-N 3.22Å; V174-K176 VanDerWaalsContact C-N 3.3Å; V174-K176 PolarHBondContact O-N 3.34Å; V174-N177 PolarHBondContact O-N 3.07Å; V174-L178 HydrophobicContact CG1-CD1 4.14Å; V174-L178 WeakPolarHBondContact O-CG 3.36Å; V174-L178 PolarHBondContact O-N 3.45Å; V174-L178 VanDerWaalsContact O-N 3.09Å
175	V	78.9	Confident	73	Confident	0 Å²	0	49.8 Å²	49.8	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-59.4	-42.3	179.5	175.7	0	0	0	0	111.4	W119 V120 W159 V171 W172 N177 L178 L179	W119-V175 HydrophobicContact CH2-CG2 3.76Å; W119-V175 HydrophobicContact CZ3-CG2 3.48Å; W119-V175 VanDerWaalsContact CZ3-CG2 3.48Å; V120-V175 HydrophobicContact CG1-CG2 4.31Å; V120-V175 HydrophobicContact CG2-CG2 4.23Å; W159-V175 HydrophobicContact CB-CG1 3.85Å; W159-V175 HydrophobicContact CD2-CB 4.36Å; W159-V175 HydrophobicContact CD2-CG1 3.87Å; W159-V175 HydrophobicContact CD2-CG2 3.82Å; W159-V175 HydrophobicContact CE3-CG1 4.41Å; W159-V175 HydrophobicContact CE3-CG2 3.93Å; W159-V175 HydrophobicContact CG-CG1 3.61Å; W159-V175 HydrophobicContact CG-CG2 4.43Å; W159-V175 HydrophobicContact CH2-CG2 4.06Å; W159-V175 HydrophobicContact CZ2-CG2 3.92Å; W159-V175 HydrophobicContact CZ3-CG2 4.06Å; V171-V175 HydrophobicContact CG1-CG2 4.5Å; V171-V175 WeakPolarHBondContact O-CG2 3.36Å; V171-V175 PolarHBondContact O-N 3.36Å; W172-V175 HydrophobicContact CE3-CB 3.97Å; W172-V175 HydrophobicContact CE3-CG1 3.92Å; W172-V175 HydrophobicContact CZ3-CB 4.31Å; W172-V175 HydrophobicContact CZ3-CG1 3.77Å; W172-V175 PolarHBondContact O-N 3.04Å; V175-N177 VanDerWaalsContact C-N 3.34Å; V175-N177 PolarHBondContact O-N 3.38Å; V175-L178 PolarHBondContact O-N 3.03Å; V175-L179 HydrophobicContact CG1-CD1 3.68Å; V175-L179 HydrophobicContact CG1-CG 3.97Å; V175-L179 VanDerWaalsContact O-CB 3.31Å; V175-L179 WeakPolarHBondContact O-CB 3.1Å; V175-L179 VanDerWaalsContact O-CG 3.28Å; V175-L179 WeakPolarHBondContact O-CG 3.5Å; V175-L179 PolarHBondContact O-N 3.3Å
176	K	78.3	Confident	71.5	Confident	103 Å²	103	49.6 Å²	49.6	45%	0.448	31%	0.305	S	S	.	.	H	α-helix	trans	-61.7	-42.1	178.8	180	-177.9	176.6	-172.9	0	111.3	W172 V174 L179 I180	W172-K176 HydrophobicContact CD2-CB 4.3Å; W172-K176 HydrophobicContact CZ2-CB 4.27Å; W172-K176 HydrophobicContact CZ2-CG 4.46Å; W172-K176 WeakPolarHBondContact O-CA 3.44Å; W172-K176 WeakPolarHBondContact O-CB 3.14Å; W172-K176 PolarHBondContact O-N 2.88Å; V174-K176 VanDerWaalsContact C-N 3.3Å; V174-K176 PolarHBondContact O-N 3.34Å; K176-L179 PolarHBondContact O-N 3.28Å; K176-I180 HydrophobicContact CD-CD1 4.47Å; K176-I180 HydrophobicContact CG-CD1 3.76Å; K176-I180 HydrophobicContact CG-CG1 4.44Å; K176-I180 WeakPolarHBondContact O-CB 3.34Å; K176-I180 WeakPolarHBondContact O-CG1 3.32Å; K176-I180 PolarHBondContact O-N 3.37Å
177	N	72.7	Confident	69.7	Low	105 Å²	105	51 Å²	51	56%	0.561	30%	0.297	S	S	*	.	H	α-helix	trans	-62.5	-45.7	176.4	-70.4	-19.2	0	0	0	110.8	G173 V174 V175 L179 I180 C181	G173-N177 VanDerWaalsContact O-CG 3.28Å; G173-N177 PolarHBondContact O-N 3.32Å; G173-N177 VanDerWaalsContact O-N 3.15Å; G173-N177 PolarHBondContact O-ND2 3.24Å; V174-N177 PolarHBondContact O-N 3.07Å; V175-N177 VanDerWaalsContact C-N 3.34Å; V175-N177 PolarHBondContact O-N 3.38Å; N177-L179 PolarHBondContact O-N 3.45Å; N177-I180 PolarHBondContact O-N 3.11Å; N177-C181 PolarHBondContact O-N 3.3Å; N177-C181 VanDerWaalsContact O-N 3.07Å; N177-C181 PolarHBondContact O-SG 2.88Å; N177-C181 VanDerWaalsContact O-SG 3.36Å
178	L	69	Low	68	Low	20 Å²	20	48 Å²	48	11%	0.105	28%	0.284	C	S	.	.	H	α-helix	trans	-61.9	-43.5	175.7	-63.9	171.1	0	0	0	111.8	M114 V120 V174 V175 I180 C181 L182	M114-L178 HydrophobicContact CE-CD2 3.82Å; M114-L178 HydrophobicContact CG-CD2 3.93Å; M114-L178 HydrophobicContact SD-CD2 3.51Å; M114-L178 VanDerWaalsContact SD-CD2 3.51Å; V120-L178 HydrophobicContact CB-CD1 4.41Å; V120-L178 HydrophobicContact CG1-CD1 4.14Å; V120-L178 HydrophobicContact CG2-CD1 3.66Å; V174-L178 HydrophobicContact CG1-CD1 4.14Å; V174-L178 WeakPolarHBondContact O-CG 3.36Å; V174-L178 PolarHBondContact O-N 3.45Å; V174-L178 VanDerWaalsContact O-N 3.09Å; V175-L178 PolarHBondContact O-N 3.03Å; L178-I180 VanDerWaalsContact C-N 3.31Å; L178-I180 PolarHBondContact O-N 3.31Å; L178-C181 PolarHBondContact O-N 3.3Å; L178-L182 WeakPolarHBondContact O-CG 3.48Å; L178-L182 PolarHBondContact O-N 2.86Å
179	L	66	Low	66.3	Low	33 Å²	33	50.7 Å²	50.7	17%	0.173	30%	0.297	C	S	.	.	H	α-helix	trans	-69.2	-23	178.3	-75	178.7	0	0	0	113.6	W172 V175 K176 N177 P183	W172-L179 HydrophobicContact CH2-CD1 3.94Å; W172-L179 HydrophobicContact CZ3-CD1 3.76Å; V175-L179 HydrophobicContact CG1-CD1 3.68Å; V175-L179 HydrophobicContact CG1-CG 3.97Å; V175-L179 VanDerWaalsContact O-CB 3.31Å; V175-L179 WeakPolarHBondContact O-CB 3.1Å; V175-L179 VanDerWaalsContact O-CG 3.28Å; V175-L179 WeakPolarHBondContact O-CG 3.5Å; V175-L179 PolarHBondContact O-N 3.3Å; K176-L179 PolarHBondContact O-N 3.28Å; N177-L179 PolarHBondContact O-N 3.45Å; L179-P183 WeakPolarHBondContact O-CD 3.39Å; L179-P183 VanDerWaalsContact O-CG 3.24Å; L179-P183 WeakPolarHBondContact O-CG 3.49Å
180	I	61.1	Low	64.8	Low	101 Å²	101	51.4 Å²	51.4	52%	0.518	29%	0.291	S	S	.	.	H	α-helix	trans	-84.5	-33.7	175.2	-71	167.6	0	0	0	111.2	K176 N177 L178 L182 P183	K176-I180 HydrophobicContact CD-CD1 4.47Å; K176-I180 HydrophobicContact CG-CD1 3.76Å; K176-I180 HydrophobicContact CG-CG1 4.44Å; K176-I180 WeakPolarHBondContact O-CB 3.34Å; K176-I180 WeakPolarHBondContact O-CG1 3.32Å; K176-I180 PolarHBondContact O-N 3.37Å; N177-I180 PolarHBondContact O-N 3.11Å; L178-I180 VanDerWaalsContact C-N 3.31Å; L178-I180 PolarHBondContact O-N 3.31Å; I180-L182 VanDerWaalsContact C-N 3.28Å; I180-L182 PolarHBondContact O-N 3.28Å; I180-P183 VanDerWaalsContact O-CD 3.24Å; I180-P183 WeakPolarHBondContact O-CD 3.48Å; I180-P183 WeakPolarHBondContact O-CG 3.2Å
181	C	56.6	Low	62.9	Low	49 Å²	49	51.4 Å²	51.4	33%	0.331	29%	0.289	S	S	.	.	H	α-helix	trans	-63.8	-33.3	176.6	-74	0	0	0	0	112.6	M114 N177 L178 S184	M114-C181 HydrophobicContact CE-CB 4.29Å; M114-C181 HydrophobicContact SD-CB 4.15Å; N177-C181 PolarHBondContact O-N 3.3Å; N177-C181 VanDerWaalsContact O-N 3.07Å; N177-C181 PolarHBondContact O-SG 2.88Å; N177-C181 VanDerWaalsContact O-SG 3.36Å; L178-C181 PolarHBondContact O-N 3.3Å; C181-S184 PolarHBondContact O-OG 2.82Å
182	L	51.1	Low	61.6	Low	65 Å²	65	57.2 Å²	57.2	34%	0.34	31%	0.314	S	S	.	.	H	α-helix	trans	-70	-47.1	-179.2	-66.2	172.8	0	0	0	115.1	L178 I180 S184 S185	L178-L182 WeakPolarHBondContact O-CG 3.48Å; L178-L182 PolarHBondContact O-N 2.86Å; I180-L182 VanDerWaalsContact C-N 3.28Å; I180-L182 PolarHBondContact O-N 3.28Å; L182-S184 VanDerWaalsContact C-N 3.26Å; L182-S184 PolarHBondContact O-N 3.45Å; L182-S185 PolarHBondContact O-N 3.41Å; L182-S185 PolarHBondContact O-OG 2.82Å
183	P	48.6	Very low	60.4	Low	50 Å²	50	58.5 Å²	58.5	33%	0.325	33%	0.329	S	S	.	.	H	α-helix	trans	-70	-14.6	-177.4	22.9	-32.9	0	0	0	114.5	L179 I180 S185 S186 L187	L179-P183 WeakPolarHBondContact O-CD 3.39Å; L179-P183 VanDerWaalsContact O-CG 3.24Å; L179-P183 WeakPolarHBondContact O-CG 3.49Å; I180-P183 VanDerWaalsContact O-CD 3.24Å; I180-P183 WeakPolarHBondContact O-CD 3.48Å; I180-P183 WeakPolarHBondContact O-CG 3.2Å; P183-S185 PolarHBondContact O-N 3.31Å; P183-S186 WeakPolarHBondContact CA-OG 3.46Å; P183-S186 PolarHBondContact O-N 2.83Å; P183-S186 PolarHBondContact O-OG 2.82Å; P183-L187 VanDerWaalsContact O-CB 3.32Å; P183-L187 WeakPolarHBondContact O-CB 3.33Å; P183-L187 WeakPolarHBondContact O-CG 3.46Å; P183-L187 PolarHBondContact O-N 2.78Å
184	S	46.4	Very low	58.8	Low	47 Å²	47	58 Å²	58	33%	0.329	32%	0.32	S	S	.	.	H	α-helix	trans	-59.3	-35.9	171.1	70.3	0	0	0	0	110.7	C181 L182 V188	C181-S184 PolarHBondContact O-OG 2.82Å; L182-S184 VanDerWaalsContact C-N 3.26Å; L182-S184 PolarHBondContact O-N 3.45Å; S184-V188 WeakPolarHBondContact O-CB 3.29Å; S184-V188 WeakPolarHBondContact O-CG2 3.25Å; S184-V188 PolarHBondContact O-N 3.48Å
185	S	46.8	Very low	57.6	Low	17 Å²	17	58.7 Å²	58.7	12%	0.119	32%	0.324	C	S	.	.	H	α-helix	trans	-69.6	-43.9	176.5	70.4	0	0	0	0	113	L182 P183 V188 E189	L182-S185 PolarHBondContact O-N 3.41Å; L182-S185 PolarHBondContact O-OG 2.82Å; P183-S185 PolarHBondContact O-N 3.31Å; S185-V188 WeakPolarHBondContact O-CB 3.5Å; S185-V188 PolarHBondContact O-N 3.4Å; S185-E189 WeakPolarHBondContact O-CG 3.46Å; S185-E189 PolarHBondContact O-N 3.41Å
186	S	51.3	Low	56.6	Low	54 Å²	54	61.8 Å²	61.8	38%	0.378	34%	0.343	S	S	.	.	H	α-helix	trans	-71.2	-32.6	179	68.4	0	0	0	0	112.6	P183 E189 H190	P183-S186 WeakPolarHBondContact CA-OG 3.46Å; P183-S186 PolarHBondContact O-N 2.83Å; P183-S186 PolarHBondContact O-OG 2.82Å; S186-E189 PolarHBondContact O-N 3.3Å; S186-H190 WeakPolarHBondContact O-CB 3.4Å; S186-H190 PolarHBondContact O-N 3.17Å
187	L	48.3	Very low	55.7	Low	87 Å²	87	59.3 Å²	59.3	46%	0.455	33%	0.334	S	S	.	.	H	α-helix	trans	-66.6	-39.6	171.3	-77.3	172.7	0	0	0	111.3	P183 E189 H190 A191 V218	P183-L187 VanDerWaalsContact O-CB 3.32Å; P183-L187 WeakPolarHBondContact O-CB 3.33Å; P183-L187 WeakPolarHBondContact O-CG 3.46Å; P183-L187 PolarHBondContact O-N 2.78Å; L187-E189 VanDerWaalsContact C-N 3.33Å; L187-H190 PolarHBondContact O-N 2.9Å; L187-A191 WeakPolarHBondContact O-CB 3.36Å; L187-A191 PolarHBondContact O-N 3.28Å; L187-V218 HydrophobicContact CD2-CG1 4.21Å
188	V	51.3	Low	54.9	Low	56 Å²	56	56.1 Å²	56.1	34%	0.339	32%	0.317	S	S	.	.	H	α-helix	trans	-60.7	-46.1	173	167.9	0	0	0	0	109.7	S184 S185 A191 F192	S184-V188 WeakPolarHBondContact O-CB 3.29Å; S184-V188 WeakPolarHBondContact O-CG2 3.25Å; S184-V188 PolarHBondContact O-N 3.48Å; S185-V188 WeakPolarHBondContact O-CB 3.5Å; S185-V188 PolarHBondContact O-N 3.4Å; V188-A191 PolarHBondContact O-N 2.9Å; V188-F192 HydrophobicContact CG1-CD2 3.51Å; V188-F192 HydrophobicContact CG1-CE2 3.46Å; V188-F192 VanDerWaalsContact CG1-CE2 3.46Å; V188-F192 WeakPolarHBondContact O-CB 3.35Å; V188-F192 WeakPolarHBondContact O-CD2 3.38Å; V188-F192 PolarHBondContact O-N 3.39Å
189	E	53.3	Low	54.2	Low	62 Å²	62	59.3 Å²	59.3	29%	0.29	34%	0.337	S	S	.	.	H	α-helix	trans	-61	-45.7	175.2	-71.3	176.3	176.4	0	0	112.9	V25 S185 S186 L187 F192 S193	V25-E189 HydrophobicContact CG1-CG 4.18Å; V25-E189 WeakPolarHBondContact CG1-OE1 3.39Å; V25-E189 WeakPolarHBondContact CG1-OE2 3.31Å; S185-E189 WeakPolarHBondContact O-CG 3.46Å; S185-E189 PolarHBondContact O-N 3.41Å; S186-E189 PolarHBondContact O-N 3.3Å; L187-E189 VanDerWaalsContact C-N 3.33Å; E189-F192 PolarHBondContact O-N 3.35Å; E189-S193 WeakPolarHBondContact O-CB 3.12Å; E189-S193 PolarHBondContact O-N 3.01Å
190	H	54.3	Low	53.7	Low	95 Å²	95	62.7 Å²	62.7	44%	0.44	36%	0.36	S	S	.	.	H	α-helix	trans	-65.2	-41.1	178.8	-169.7	-100.6	0	0	0	111.4	S186 L187 S193 I194	S186-H190 WeakPolarHBondContact O-CB 3.4Å; S186-H190 PolarHBondContact O-N 3.17Å; L187-H190 PolarHBondContact O-N 2.9Å; H190-S193 WeakPolarHBondContact O-CB 3.38Å; H190-S193 PolarHBondContact O-N 3.45Å; H190-I194 WeakPolarHBondContact CE1-CD1 3.25Å; H190-I194 WeakPolarHBondContact ND1-CD1 3.45Å; H190-I194 WeakPolarHBondContact O-CG1 3.32Å; H190-I194 PolarHBondContact O-N 2.85Å
191	A	49	Very low	53.5	Low	27 Å²	27	64.3 Å²	64.3	22%	0.223	36%	0.363	C	S	.	.	H	α-helix	trans	-62.8	-45.2	173.6	0	0	0	0	0	111.5	L187 V188 S193 I194 V195 V218	L187-A191 WeakPolarHBondContact O-CB 3.36Å; L187-A191 PolarHBondContact O-N 3.28Å; V188-A191 PolarHBondContact O-N 2.9Å; A191-S193 VanDerWaalsContact C-N 3.32Å; A191-S193 PolarHBondContact O-N 3.08Å; A191-I194 PolarHBondContact O-N 3.16Å; A191-V195 WeakPolarHBondContact O-CB 3.48Å; A191-V195 VanDerWaalsContact O-CG2 3.25Å; A191-V195 WeakPolarHBondContact O-CG2 3.34Å; A191-V195 PolarHBondContact O-N 3.01Å; A191-V218 HydrophobicContact CB-CG2 3.9Å
192	F	57.5	Low	53.2	Low	121 Å²	121	64.6 Å²	64.6	53%	0.531	36%	0.358	S	S	.	.	H	α-helix	trans	-62.9	-38.2	174.2	-86	-66.4	0	0	0	112	V188 E189 V195 T196	V188-F192 HydrophobicContact CG1-CD2 3.51Å; V188-F192 HydrophobicContact CG1-CE2 3.46Å; V188-F192 VanDerWaalsContact CG1-CE2 3.46Å; V188-F192 WeakPolarHBondContact O-CB 3.35Å; V188-F192 WeakPolarHBondContact O-CD2 3.38Å; V188-F192 PolarHBondContact O-N 3.39Å; E189-F192 PolarHBondContact O-N 3.35Å; F192-V195 PolarHBondContact O-N 2.86Å; F192-T196 WeakPolarHBondContact O-CB 3.48Å; F192-T196 VanDerWaalsContact O-CG2 3.31Å; F192-T196 WeakPolarHBondContact O-CG2 3Å; F192-T196 PolarHBondContact O-N 2.91Å; F192-T196 PolarHBondContact O-OG1 2.77Å
193	S	61.2	Low	53	Low	65 Å²	65	66.6 Å²	66.6	46%	0.455	38%	0.377	S	S	.	.	H	α-helix	trans	-63.3	-43.5	175.2	-174.5	0	0	0	0	111.6	E189 H190 A191 T196 D197	E189-S193 WeakPolarHBondContact O-CB 3.12Å; E189-S193 PolarHBondContact O-N 3.01Å; H190-S193 WeakPolarHBondContact O-CB 3.38Å; H190-S193 PolarHBondContact O-N 3.45Å; A191-S193 VanDerWaalsContact C-N 3.32Å; A191-S193 PolarHBondContact O-N 3.08Å; S193-T196 WeakPolarHBondContact CA-OG1 2.99Å; S193-T196 PolarHBondContact O-N 2.93Å; S193-T196 PolarHBondContact O-OG1 3.02Å; S193-D197 WeakPolarHBondContact O-CB 3.4Å; S193-D197 PolarHBondContact O-N 3.41Å
194	I	53.9	Low	53.2	Low	17 Å²	17	68.8 Å²	68.8	9%	0.087	39%	0.393	C	S	.	.	H	α-helix	trans	-63.9	-45.9	174.5	-70.5	163.3	0	0	0	110.8	H190 A191 T196 D197 L198 V214 R217 V218	H190-I194 WeakPolarHBondContact CE1-CD1 3.25Å; H190-I194 WeakPolarHBondContact ND1-CD1 3.45Å; H190-I194 WeakPolarHBondContact O-CG1 3.32Å; H190-I194 PolarHBondContact O-N 2.85Å; A191-I194 PolarHBondContact O-N 3.16Å; I194-T196 VanDerWaalsContact C-N 3.31Å; I194-T196 PolarHBondContact O-N 2.82Å; I194-D197 PolarHBondContact O-N 3.46Å; I194-L198 WeakPolarHBondContact O-CB 3.48Å; I194-L198 PolarHBondContact O-N 3.5Å; I194-V214 HydrophobicContact CG2-CG1 4.38Å; I194-R217 HydrophobicContact CD1-CB 3.69Å; I194-R217 WeakPolarHBondContact CD1-O 3.49Å; I194-R217 HydrophobicContact CG1-CB 4.34Å; I194-R217 HydrophobicContact CG2-CB 4.16Å; I194-V218 HydrophobicContact CD1-CB 4.34Å; I194-V218 HydrophobicContact CD1-CG2 3.61Å
195	V	54.2	Low	53.2	Low	59 Å²	59	75.9 Å²	75.9	36%	0.358	41%	0.413	S	S	.	.	H	α-helix	trans	-62.5	-40.2	179.2	169.9	0	0	0	0	110.7	A191 F192 L198 V199 V214	A191-V195 WeakPolarHBondContact O-CB 3.48Å; A191-V195 VanDerWaalsContact O-CG2 3.25Å; A191-V195 WeakPolarHBondContact O-CG2 3.34Å; A191-V195 PolarHBondContact O-N 3.01Å; F192-V195 PolarHBondContact O-N 2.86Å; V195-L198 WeakPolarHBondContact O-CB 3.44Å; V195-L198 PolarHBondContact O-N 2.97Å; V195-V199 HydrophobicContact CG1-CG2 4.41Å; V195-V199 WeakPolarHBondContact O-CB 3.22Å; V195-V199 VanDerWaalsContact O-CG2 3.25Å; V195-V199 WeakPolarHBondContact O-CG2 3.42Å; V195-V199 PolarHBondContact O-N 2.87Å; V195-V214 HydrophobicContact CG2-CG1 4.3Å
196	T	56.8	Low	52.9	Low	65 Å²	65	83.9 Å²	83.9	40%	0.399	45%	0.453	S	S	.	.	H	α-helix	trans	-69.4	-43.4	176.8	49.7	0	0	0	0	112.1	F192 S193 I194 L198 V199 T200	F192-T196 WeakPolarHBondContact O-CB 3.48Å; F192-T196 VanDerWaalsContact O-CG2 3.31Å; F192-T196 WeakPolarHBondContact O-CG2 3Å; F192-T196 PolarHBondContact O-N 2.91Å; F192-T196 PolarHBondContact O-OG1 2.77Å; S193-T196 WeakPolarHBondContact CA-OG1 2.99Å; S193-T196 PolarHBondContact O-N 2.93Å; S193-T196 PolarHBondContact O-OG1 3.02Å; I194-T196 VanDerWaalsContact C-N 3.31Å; I194-T196 PolarHBondContact O-N 2.82Å; T196-L198 VanDerWaalsContact C-N 3.25Å; T196-L198 PolarHBondContact O-N 2.86Å; T196-V199 PolarHBondContact O-N 3.4Å; T196-T200 VanDerWaalsContact O-CB 3.32Å; T196-T200 WeakPolarHBondContact O-CB 3.26Å; T196-T200 VanDerWaalsContact O-CG2 3.24Å; T196-T200 WeakPolarHBondContact O-CG2 3.39Å; T196-T200 PolarHBondContact O-N 3.18Å; T196-T200 PolarHBondContact O-OG1 2.89Å
197	D	60.1	Low	52.7	Low	50 Å²	50	87.8 Å²	87.8	27%	0.267	47%	0.465	S	S	.	.	H	α-helix	trans	-58.4	-40.7	171.6	-176.3	67.1	0	0	0	111	S193 I194 T200 K201 R217	S193-D197 WeakPolarHBondContact O-CB 3.4Å; S193-D197 PolarHBondContact O-N 3.41Å; I194-D197 PolarHBondContact O-N 3.46Å; D197-T200 WeakPolarHBondContact CA-OG1 3.42Å; D197-T200 PolarHBondContact O-N 3.29Å; D197-T200 PolarHBondContact O-OG1 3.37Å; D197-K201 VanDerWaalsContact O-CB 3.3Å; D197-K201 WeakPolarHBondContact O-CB 3.44Å; D197-K201 PolarHBondContact O-N 3.35Å; D197-K201 WeakPolarHBondContact OD1-CD 3.25Å; D197-K201 WeakPolarHBondContact OD1-CE 3.48Å; D197-K201 IonicContact OD1-NZ 2.84Å; D197-K201 PolarHBondContact OD1-NZ 3.38Å; D197-K201 IonicContact OD2-NZ 3.03Å; D197-R217 IonicContact OD2-NH1 2.83Å
198	L	56.1	Low	52.8	Low	38 Å²	38	90.5 Å²	90.5	20%	0.199	49%	0.485	C	S	.	.	H	α-helix	trans	-65.4	-47.7	179.4	-168.1	69.2	0	0	0	112.3	I194 V195 T196 K202 V209 V214	I194-L198 WeakPolarHBondContact O-CB 3.48Å; I194-L198 PolarHBondContact O-N 3.5Å; V195-L198 WeakPolarHBondContact O-CB 3.44Å; V195-L198 PolarHBondContact O-N 2.97Å; T196-L198 VanDerWaalsContact C-N 3.25Å; T196-L198 PolarHBondContact O-N 2.86Å; L198-K202 HydrophobicContact CD1-CD 3.98Å; L198-K202 WeakPolarHBondContact O-CA 3.46Å; L198-K202 WeakPolarHBondContact O-CB 3.16Å; L198-K202 PolarHBondContact O-N 3.23Å; L198-V209 HydrophobicContact CD1-CB 4.3Å; L198-V209 HydrophobicContact CD1-CG1 4.01Å; L198-V209 HydrophobicContact CD1-CG2 3.43Å; L198-V209 VanDerWaalsContact CD1-CG2 3.43Å; L198-V209 HydrophobicContact CD2-CB 3.88Å; L198-V209 HydrophobicContact CD2-CG1 3.62Å; L198-V209 HydrophobicContact CD2-CG2 3.71Å; L198-V209 HydrophobicContact CG-CB 4.39Å; L198-V209 HydrophobicContact CG-CG1 4.32Å; L198-V209 HydrophobicContact CG-CG2 3.67Å; L198-V214 HydrophobicContact CD2-CG2 3.88Å
199	V	55.4	Low	52.6	Low	87 Å²	87	89.5 Å²	89.5	53%	0.527	48%	0.48	S	S	.	.	H	α-helix	trans	-66.4	-41.8	177.9	172.8	0	0	0	0	110.4	V195 T196 C203	V195-V199 HydrophobicContact CG1-CG2 4.41Å; V195-V199 WeakPolarHBondContact O-CB 3.22Å; V195-V199 VanDerWaalsContact O-CG2 3.25Å; V195-V199 WeakPolarHBondContact O-CG2 3.42Å; V195-V199 PolarHBondContact O-N 2.87Å; T196-V199 PolarHBondContact O-N 3.4Å; V199-C203 VanDerWaalsContact O-CB 3.28Å; V199-C203 WeakPolarHBondContact O-CB 3.46Å; V199-C203 PolarHBondContact O-N 2.89Å; V199-C203 PolarHBondContact O-SG 3.41Å
200	T	55.4	Low	52.6	Low	105 Å²	105	95.7 Å²	95.7	64%	0.644	50%	0.5	S	S	*	.	H	α-helix	trans	-74.4	-46.9	-176.9	54.3	0	0	0	0	113.4	T196 D197	T196-T200 VanDerWaalsContact O-CB 3.32Å; T196-T200 WeakPolarHBondContact O-CB 3.26Å; T196-T200 VanDerWaalsContact O-CG2 3.24Å; T196-T200 WeakPolarHBondContact O-CG2 3.39Å; T196-T200 PolarHBondContact O-N 3.18Å; T196-T200 PolarHBondContact O-OG1 2.89Å; D197-T200 WeakPolarHBondContact CA-OG1 3.42Å; D197-T200 PolarHBondContact O-N 3.29Å; D197-T200 PolarHBondContact O-OG1 3.37Å
201	K	56.3	Low	52.5	Low	135 Å²	135	96.6 Å²	96.6	59%	0.587	52%	0.515	S	S	*	.	H	α-helix	trans	-75.4	-40.3	178.4	-79.9	-175.3	178.3	132.4	0	112.4	D197 S204	D197-K201 VanDerWaalsContact O-CB 3.3Å; D197-K201 WeakPolarHBondContact O-CB 3.44Å; D197-K201 PolarHBondContact O-N 3.35Å; D197-K201 WeakPolarHBondContact OD1-CD 3.25Å; D197-K201 WeakPolarHBondContact OD1-CE 3.48Å; D197-K201 IonicContact OD1-NZ 2.84Å; D197-K201 PolarHBondContact OD1-NZ 3.38Å; D197-K201 IonicContact OD2-NZ 3.03Å; K201-S204 PolarHBondContact O-N 3.39Å; K201-S204 PolarHBondContact O-OG 2.84Å
202	K	50.3	Low	52.5	Low	54 Å²	54	98 Å²	98	24%	0.235	53%	0.526	C	S	.	.	H	α-helix	trans	-88.9	-15.6	-167.6	-138.7	175.3	179.8	-169.3	0	114	L198 S204 R205 Q207 V209	L198-K202 HydrophobicContact CD1-CD 3.98Å; L198-K202 WeakPolarHBondContact O-CA 3.46Å; L198-K202 WeakPolarHBondContact O-CB 3.16Å; L198-K202 PolarHBondContact O-N 3.23Å; K202-S204 PolarHBondContact O-N 3.44Å; K202-S204 VanDerWaalsContact O-N 3.14Å; K202-R205 CarbonylContact O-C 3.45Å; K202-R205 VanDerWaalsContact O-C 3.28Å; K202-R205 PolarHBondContact O-N 2.89Å; K202-Q207 HydrophobicContact CD-CB 4.47Å; K202-Q207 WeakPolarHBondContact CD-O 3.01Å; K202-Q207 WeakPolarHBondContact CE-O 3.46Å; K202-Q207 PolarHBondContact NZ-O 3.34Å; K202-Q207 VanDerWaalsContact NZ-O 3.11Å; K202-V209 HydrophobicContact CD-CG2 3.33Å; K202-V209 VanDerWaalsContact NZ-CG2 3.28Å
203	C	46.5	Very low	52.2	Low	108 Å²	108	95.5 Å²	95.5	73%	0.73	52%	0.518	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.6	-12.3	165.7	-78	0	0	0	0	113.4	V199	V199-C203 VanDerWaalsContact O-CB 3.28Å; V199-C203 WeakPolarHBondContact O-CB 3.46Å; V199-C203 PolarHBondContact O-N 2.89Å; V199-C203 PolarHBondContact O-SG 3.41Å
204	S	53.5	Low	51.5	Low	95 Å²	95	94 Å²	94	66%	0.664	51%	0.506	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.7	-18.3	169.8	69.9	0	0	0	0	113.8	K201 K202	K201-S204 PolarHBondContact O-N 3.39Å; K201-S204 PolarHBondContact O-OG 2.84Å; K202-S204 PolarHBondContact O-N 3.44Å; K202-S204 VanDerWaalsContact O-N 3.14Å
205	R	46.5	Very low	51.2	Low	196 Å²	196	102.5 Å²	102.5	74%	0.74	54%	0.537	S	S	*	.	S	Bend	trans	-149.8	104.5	-177.5	-63.6	177.8	68.5	-165.4	1.2	110.5	K202 Q207	K202-R205 CarbonylContact O-C 3.45Å; K202-R205 VanDerWaalsContact O-C 3.28Å; K202-R205 PolarHBondContact O-N 2.89Å; R205-Q207 PolarHBondContact O-N 3.11Å
206	L	40.8	Very low	50.9	Low	186 Å²	186	104.8 Å²	104.8	97%	0.974	55%	0.547	S	S	*	.			trans	-47.8	82.2	179.7	-67	167	0	0	0	114.5
207	Q	45.5	Very low	50.6	Low	135 Å²	135	108.8 Å²	108.8	63%	0.631	55%	0.554	S	S	*	*			trans	-127.9	105.5	164.7	-91.4	-172.5	18.7	0	0	108.2	K202 R205 V209	K202-Q207 HydrophobicContact CD-CB 4.47Å; K202-Q207 WeakPolarHBondContact CD-O 3.01Å; K202-Q207 WeakPolarHBondContact CE-O 3.46Å; K202-Q207 PolarHBondContact NZ-O 3.34Å; K202-Q207 VanDerWaalsContact NZ-O 3.11Å; R205-Q207 PolarHBondContact O-N 3.11Å; Q207-V209 PolarHBondContact O-N 2.72Å; Q207-V209 VanDerWaalsContact O-N 3.13Å
208	V	52	Low	49.7	Very low	144 Å²	144	107.9 Å²	107.9	87%	0.873	55%	0.551	S	S	*	*	P	Polyproline II helix	trans	-50.6	117.8	172.1	-179.6	0	0	0	0	108.3
209	V	47.2	Very low	49	Very low	36 Å²	36	108.6 Å²	108.6	22%	0.218	56%	0.557	C	S	.	*	P	Polyproline II helix	trans	-82.5	126.9	179.3	-176	0	0	0	0	106.9	L198 K202 Q207 D213 V214	L198-V209 HydrophobicContact CD1-CB 4.3Å; L198-V209 HydrophobicContact CD1-CG1 4.01Å; L198-V209 HydrophobicContact CD1-CG2 3.43Å; L198-V209 VanDerWaalsContact CD1-CG2 3.43Å; L198-V209 HydrophobicContact CD2-CB 3.88Å; L198-V209 HydrophobicContact CD2-CG1 3.62Å; L198-V209 HydrophobicContact CD2-CG2 3.71Å; L198-V209 HydrophobicContact CG-CB 4.39Å; L198-V209 HydrophobicContact CG-CG1 4.32Å; L198-V209 HydrophobicContact CG-CG2 3.67Å; K202-V209 HydrophobicContact CD-CG2 3.33Å; K202-V209 VanDerWaalsContact NZ-CG2 3.28Å; Q207-V209 PolarHBondContact O-N 2.72Å; Q207-V209 VanDerWaalsContact O-N 3.13Å; V209-D213 HydrophobicContact CG1-CB 3.69Å; V209-V214 HydrophobicContact CG1-CG2 4.5Å
210	R	51.4	Low	48.6	Very low	192 Å²	192	110.9 Å²	110.9	73%	0.725	58%	0.576	S	S	*	*	P	Polyproline II helix	trans	-74.9	140.5	175.3	-70.2	-177.6	175.2	167.2	-1.7	107.8	A212 D213	R210-A212 PolarHBondContact O-N 2.77Å; R210-D213 PolarHBondContact N-OD2 3.29Å; R210-D213 VanDerWaalsContact N-OD2 3.12Å; R210-D213 WeakPolarHBondContact O-CB 3.28Å; R210-D213 PolarHBondContact O-N 3.27Å
211	P	52.2	Low	48.2	Very low	114 Å²	114	111.9 Å²	111.9	74%	0.74	58%	0.577	S	S	*	*	H	α-helix	trans	-50.5	-26.5	177.6	-29.7	35.3	0	0	0	114.6
212	A	49.5	Very low	47.7	Very low	56 Å²	56	114.5 Å²	114.5	46%	0.463	59%	0.591	S	S	.	*	H	α-helix	trans	-65.3	-31.2	174.9	0	0	0	0	0	114.2	R210 V214 R215 L216	R210-A212 PolarHBondContact O-N 2.77Å; A212-V214 VanDerWaalsContact C-N 3.3Å; A212-V214 PolarHBondContact O-N 3.35Å; A212-R215 PolarHBondContact O-N 3.35Å; A212-L216 PolarHBondContact O-N 2.87Å
213	D	51.3	Low	47.5	Very low	68 Å²	68	116.1 Å²	116.1	36%	0.364	60%	0.602	S	S	.	*	H	α-helix	trans	-67.2	-33.5	-177.8	-60.2	-29	0	0	0	111.6	V209 R210 R217	V209-D213 HydrophobicContact CG1-CB 3.69Å; R210-D213 PolarHBondContact N-OD2 3.29Å; R210-D213 VanDerWaalsContact N-OD2 3.12Å; R210-D213 WeakPolarHBondContact O-CB 3.28Å; R210-D213 PolarHBondContact O-N 3.27Å; D213-R217 PolarHBondContact O-N 3.32Å
214	V	46.6	Very low	47.9	Very low	34 Å²	34	115.9 Å²	115.9	21%	0.206	59%	0.593	C	S	.	*	H	α-helix	trans	-67.9	-45.7	174.9	178.8	0	0	0	0	109.8	I194 V195 L198 V209 A212 L216 R217 V218	I194-V214 HydrophobicContact CG2-CG1 4.38Å; V195-V214 HydrophobicContact CG2-CG1 4.3Å; L198-V214 HydrophobicContact CD2-CG2 3.88Å; V209-V214 HydrophobicContact CG1-CG2 4.5Å; A212-V214 VanDerWaalsContact C-N 3.3Å; A212-V214 PolarHBondContact O-N 3.35Å; V214-L216 VanDerWaalsContact C-N 3.33Å; V214-L216 PolarHBondContact O-N 3.4Å; V214-R217 PolarHBondContact O-N 3.44Å; V214-V218 HydrophobicContact CG1-CG2 4.21Å; V214-V218 VanDerWaalsContact O-CG2 3.29Å; V214-V218 WeakPolarHBondContact O-CG2 3.4Å; V214-V218 PolarHBondContact O-N 3.39Å
215	R	48.7	Very low	48.2	Very low	196 Å²	196	117 Å²	117	74%	0.74	59%	0.591	S	S	*	*	H	α-helix	trans	-57.5	-46.1	177	-79.5	-176.8	167.3	-171.9	-3.3	111.7	A212 R217 V218 T219	A212-R215 PolarHBondContact O-N 3.35Å; R215-R217 VanDerWaalsContact C-N 3.26Å; R215-R217 PolarHBondContact O-N 3.02Å; R215-V218 PolarHBondContact O-N 3.12Å; R215-T219 PolarHBondContact O-N 3.13Å; R215-T219 PolarHBondContact O-OG1 2.99Å
216	L	47.1	Very low	49	Very low	106 Å²	106	113.1 Å²	113.1	56%	0.555	59%	0.585	S	S	*	*	H	α-helix	trans	-61.4	-31.4	179.1	-77.1	167.7	0	0	0	113.3	A212 V214 L223	A212-L216 PolarHBondContact O-N 2.87Å; V214-L216 VanDerWaalsContact C-N 3.33Å; V214-L216 PolarHBondContact O-N 3.4Å; L216-L223 HydrophobicContact CD2-CD1 4.03Å
217	R	51.2	Low	50.5	Low	149 Å²	149	111.8 Å²	111.8	56%	0.562	57%	0.571	S	S	*	*	H	α-helix	trans	-83.7	-28.8	177.2	-74.3	-172.6	171	-158.3	-2.4	113.8	I194 D197 D213 V214 R215	I194-R217 HydrophobicContact CD1-CB 3.69Å; I194-R217 WeakPolarHBondContact CD1-O 3.49Å; I194-R217 HydrophobicContact CG1-CB 4.34Å; I194-R217 HydrophobicContact CG2-CB 4.16Å; D197-R217 IonicContact OD2-NH1 2.83Å; D213-R217 PolarHBondContact O-N 3.32Å; V214-R217 PolarHBondContact O-N 3.44Å; R215-R217 VanDerWaalsContact C-N 3.26Å; R215-R217 PolarHBondContact O-N 3.02Å
218	V	39.3	Very low	50.5	Low	31 Å²	31	110.1 Å²	110.1	19%	0.188	57%	0.566	C	S	.	*	H	α-helix	trans	-72	-34.8	-179.1	171.8	0	0	0	0	111.3	L187 A191 I194 V214 R215	L187-V218 HydrophobicContact CD2-CG1 4.21Å; A191-V218 HydrophobicContact CB-CG2 3.9Å; I194-V218 HydrophobicContact CD1-CB 4.34Å; I194-V218 HydrophobicContact CD1-CG2 3.61Å; V214-V218 HydrophobicContact CG1-CG2 4.21Å; V214-V218 VanDerWaalsContact O-CG2 3.29Å; V214-V218 WeakPolarHBondContact O-CG2 3.4Å; V214-V218 PolarHBondContact O-N 3.39Å; R215-V218 PolarHBondContact O-N 3.12Å
219	T	42.5	Very low	50.9	Low	54 Å²	54	108 Å²	108	33%	0.331	55%	0.553	S	S	.	*			trans	-109.8	114.5	178.3	60.8	0	0	0	0	110.5	R215 I221	R215-T219 PolarHBondContact O-N 3.13Å; R215-T219 PolarHBondContact O-OG1 2.99Å; T219-I221 PolarHBondContact O-N 3.39Å; T219-I221 VanDerWaalsContact O-N 3.11Å
220	S	45.9	Very low	51.9	Low	134 Å²	134	116.6 Å²	116.6	94%	0.937	58%	0.582	S	S	*	*			trans	-67.7	1.1	165.4	36.9	0	0	0	0	113.2	E222	S220-E222 PolarHBondContact O-N 3.37Å
221	I	48.8	Very low	52.6	Low	127 Å²	127	111.1 Å²	111.1	65%	0.651	57%	0.573	S	S	*	*	S	Bend	trans	-73.2	116.1	172.2	-59.3	169.8	0	0	0	107.9	T219 L223	T219-I221 PolarHBondContact O-N 3.39Å; T219-I221 VanDerWaalsContact O-N 3.11Å; I221-L223 PolarHBondContact O-N 2.83Å
222	E	45.9	Very low	52.3	Low	189 Å²	189	114.2 Å²	114.2	88%	0.883	57%	0.571	S	S	*	*			trans	-62.1	109.6	172.6	-159.7	170	-158.3	0	0	108.8	S220 N224	S220-E222 PolarHBondContact O-N 3.37Å; E222-N224 PolarHBondContact O-N 3.18Å
223	L	46	Very low	52	Low	88 Å²	88	116.9 Å²	116.9	46%	0.461	58%	0.583	S	S	.	*			trans	-66.6	121.6	-179.6	-89.9	157.3	0	0	0	109	L216 I221 I225	L216-L223 HydrophobicContact CD2-CD1 4.03Å; I221-L223 PolarHBondContact O-N 2.83Å; L223-I225 VanDerWaalsContact C-N 3.3Å; L223-I225 WeakPolarHBondContact O-CG1 3.32Å; L223-I225 PolarHBondContact O-N 2.88Å
224	N	54.8	Low	51.9	Low	103 Å²	103	117 Å²	117	55%	0.551	60%	0.601	S	S	*	*			trans	-71.2	87.3	173.1	-173	-35.3	0	0	0	109.5	E222 D226 K227 L228	E222-N224 PolarHBondContact O-N 3.18Å; N224-D226 VanDerWaalsContact C-N 3.26Å; N224-D226 PolarHBondContact O-N 2.7Å; N224-D226 PolarHBondContact OD1-N 3.5Å; N224-K227 HydrophobicContact CB-CB 4.23Å; N224-K227 PolarHBondContact O-N 3Å; N224-K227 PolarHBondContact OD1-N 3.45Å; N224-L228 PolarHBondContact O-N 3.11Å
225	I	58.5	Low	51.6	Low	120 Å²	120	123.9 Å²	123.9	62%	0.615	63%	0.63	S	S	*	*	H	α-helix	trans	-59.8	-38.4	-176.3	-52.9	-178.3	0	0	0	110.6	L223 K227 L228 V229	L223-I225 VanDerWaalsContact C-N 3.3Å; L223-I225 WeakPolarHBondContact O-CG1 3.32Å; L223-I225 PolarHBondContact O-N 2.88Å; I225-K227 VanDerWaalsContact C-N 3.3Å; I225-K227 PolarHBondContact O-N 3.13Å; I225-L228 WeakPolarHBondContact O-CA 3.3Å; I225-L228 WeakPolarHBondContact O-CB 3.24Å; I225-L228 PolarHBondContact O-N 3.24Å; I225-V229 HydrophobicContact CG2-CG2 4.06Å; I225-V229 WeakPolarHBondContact O-CG2 3.35Å; I225-V229 PolarHBondContact O-N 3.34Å
226	D	65	Low	51.3	Low	114 Å²	114	119.9 Å²	119.9	61%	0.61	63%	0.63	S	S	*	*	H	α-helix	trans	-59.6	-40.6	179.3	-67.3	-41.2	0	0	0	112.1	N224 L228 R230	N224-D226 VanDerWaalsContact C-N 3.26Å; N224-D226 PolarHBondContact O-N 2.7Å; N224-D226 PolarHBondContact OD1-N 3.5Å; D226-L228 VanDerWaalsContact C-N 3.32Å; D226-L228 PolarHBondContact O-N 2.74Å; D226-R230 WeakPolarHBondContact O-CB 3.38Å; D226-R230 WeakPolarHBondContact O-CG 3.24Å; D226-R230 PolarHBondContact O-N 3Å
227	K	71.7	Confident	51.2	Low	157 Å²	157	120.7 Å²	120.7	68%	0.683	64%	0.644	S	S	*	*	H	α-helix	trans	-64	-39.7	174.9	-169.4	178.9	-179.2	-179	0	111.3	N224 I225 S231	N224-K227 HydrophobicContact CB-CB 4.23Å; N224-K227 PolarHBondContact O-N 3Å; N224-K227 PolarHBondContact OD1-N 3.45Å; I225-K227 VanDerWaalsContact C-N 3.3Å; I225-K227 PolarHBondContact O-N 3.13Å; K227-S231 WeakPolarHBondContact O-CB 3.09Å; K227-S231 PolarHBondContact O-N 3.14Å; K227-S231 VanDerWaalsContact O-N 3.14Å; K227-S231 PolarHBondContact O-OG 3.34Å
228	L	44.9	Very low	50.8	Low	101 Å²	101	118.4 Å²	118.4	53%	0.529	65%	0.652	S	S	.	*	H	α-helix	trans	-68.1	-45	-179.6	-146.9	95.7	0	0	0	111.6	N224 I225 D226 S231 Y232	N224-L228 PolarHBondContact O-N 3.11Å; I225-L228 WeakPolarHBondContact O-CA 3.3Å; I225-L228 WeakPolarHBondContact O-CB 3.24Å; I225-L228 PolarHBondContact O-N 3.24Å; D226-L228 VanDerWaalsContact C-N 3.32Å; D226-L228 PolarHBondContact O-N 2.74Å; L228-S231 WeakPolarHBondContact CA-OG 3.42Å; L228-S231 PolarHBondContact O-N 3.42Å; L228-S231 VanDerWaalsContact O-N 3.14Å; L228-S231 PolarHBondContact O-OG 3.13Å; L228-Y232 PolarHBondContact O-N 3.45Å
229	V	61.5	Low	50.6	Low	99 Å²	99	122.2 Å²	122.2	60%	0.6	68%	0.679	S	S	*	*	H	α-helix	trans	-64.2	-43.3	178.7	173.6	0	0	0	0	110.8	I225 S231 Y232	I225-V229 HydrophobicContact CG2-CG2 4.06Å; I225-V229 WeakPolarHBondContact O-CG2 3.35Å; I225-V229 PolarHBondContact O-N 3.34Å; V229-S231 PolarHBondContact O-N 2.63Å; V229-Y232 PolarHBondContact O-N 2.84Å
230	R	67.2	Low	50.2	Low	217 Å²	217	131.4 Å²	131.4	82%	0.819	73%	0.725	S	S	*	*	H	α-helix	trans	-62.7	-29.3	174.5	-74	-179.7	-168	173.2	5.6	113.2	D226	D226-R230 WeakPolarHBondContact O-CB 3.38Å; D226-R230 WeakPolarHBondContact O-CG 3.24Å; D226-R230 PolarHBondContact O-N 3Å
231	S	65.7	Low	50.4	Low	77 Å²	77	131.3 Å²	131.3	54%	0.538	71%	0.714	S	S	.	*	H	α-helix	trans	-83.5	-10.4	-179.8	69.5	0	0	0	0	114.2	K227 L228 V229 P233	K227-S231 WeakPolarHBondContact O-CB 3.09Å; K227-S231 PolarHBondContact O-N 3.14Å; K227-S231 VanDerWaalsContact O-N 3.14Å; K227-S231 PolarHBondContact O-OG 3.34Å; L228-S231 WeakPolarHBondContact CA-OG 3.42Å; L228-S231 PolarHBondContact O-N 3.42Å; L228-S231 VanDerWaalsContact O-N 3.14Å; L228-S231 PolarHBondContact O-OG 3.13Å; V229-S231 PolarHBondContact O-N 2.63Å; S231-P233 WeakPolarHBondContact O-CD 3.22Å
232	Y	46.3	Very low	50.5	Low	179 Å²	179	131.5 Å²	131.5	70%	0.702	72%	0.718	S	S	*	*			trans	-87.6	103.6	173.1	-112.7	-99.9	0	0	0	108.3	L228 V229 G234	L228-Y232 PolarHBondContact O-N 3.45Å; V229-Y232 PolarHBondContact O-N 2.84Å; Y232-G234 PolarHBondContact O-N 2.76Å; Y232-G234 VanDerWaalsContact O-N 3.09Å
233	P	43.7	Very low	50.8	Low	111 Å²	111	128.3 Å²	128.3	72%	0.721	71%	0.709	S	S	*	*			trans	-68.7	111.2	165.8	3.4	16.2	0	0	0	104.8	S231 E235	S231-P233 WeakPolarHBondContact O-CD 3.22Å; P233-E235 PolarHBondContact O-N 3.2Å
234	G	48.7	Very low	51.1	Low	71 Å²	71	130.6 Å²	130.6	73%	0.732	72%	0.723	S	S	*	*			trans	-56.8	109.3	176	0	0	0	0	0	108.8	Y232 P236	Y232-G234 PolarHBondContact O-N 2.76Å; Y232-G234 VanDerWaalsContact O-N 3.09Å; G234-P236 VanDerWaalsContact O-CD 3.22Å; G234-P236 WeakPolarHBondContact O-CD 3.49Å
235	E	39.8	Very low	50.8	Low	178 Å²	178	132.4 Å²	132.4	83%	0.832	73%	0.734	S	S	*	*			trans	-67.9	114.3	161.9	-89.3	-177.5	149.6	0	0	106.6	P233 S237	P233-E235 PolarHBondContact O-N 3.2Å; E235-S237 PolarHBondContact O-N 3.41Å
236	P	43.8	Very low	50.3	Low	112 Å²	112	133.2 Å²	133.2	73%	0.727	74%	0.742	S	S	*	*			trans	-68.4	106.3	172.3	28.1	-27.7	0	0	0	106.2	G234 S238	G234-P236 VanDerWaalsContact O-CD 3.22Å; G234-P236 WeakPolarHBondContact O-CD 3.49Å; P236-S238 PolarHBondContact O-N 3.48Å; P236-S238 PolarHBondContact O-OG 3.46Å
237	S	44.8	Very low	49.3	Very low	123 Å²	123	134.6 Å²	134.6	86%	0.86	75%	0.751	S	S	*	*			trans	-65.9	95.3	167.3	-62.5	0	0	0	0	107.3	E235 S239	E235-S237 PolarHBondContact O-N 3.41Å; S237-S239 PolarHBondContact O-N 3.44Å
238	S	42.4	Very low	47.5	Very low	102 Å²	102	132.8 Å²	132.8	71%	0.713	76%	0.757	S	S	*	*			trans	-53.5	124.7	172.4	-53	0	0	0	0	110.2	P236	P236-S238 PolarHBondContact O-N 3.48Å; P236-S238 PolarHBondContact O-OG 3.46Å
239	S	34.7	Very low	47.8	Very low	110 Å²	110	135.5 Å²	135.5	77%	0.769	78%	0.776	S	S	*	*			trans	-9.4	121.6	151	51.1	0	0	0	0	116.3	S237	S237-S239 PolarHBondContact O-N 3.44Å
240	L	34.6	Very low	46.5	Very low	247 Å²	247	138.8 Å²	138.8	100%	1.293	79%	0.792	S	S	*	*				-164	0	117.3	-98.1	163.8	0	0	0	110.3

Retrieved 240 of 240 residues in 1524 ms (Link to these results)

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