A0A5K4FB98_SCHMA Loading...

Plac8 onzin related protein 2

AlphaFold DB , UniProt , Accession A0A5K4FB98, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 141 aa.

						>A0A5K4FB98_SCHMA|A0A5K4FB98
MQSQKQVGTILDQPGKSVPPRNLTLVPPPHRQWTGGICYCCKNRDWGCFAVCCYFCLLNQLTKAMNEKTCYPCLPWCGLVGLRMKMRTSYGIEGDGCKDCCQLCFCNGCIACQMHYEAQQIGVIEKKTCSDACNHCCVCYR
					

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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	43.4	Very low	59.3	Low	247 Å²	247	131.4 Å²	131.4	100%	1.217	68%	0.68	S	S	*	*				0	106.7	0	-65	164	97.4	0	0	107.3	S3	M1-S3 PolarHBondContact O-N 3.48Å
2	Q	44	Very low	60.5	Low	195 Å²	195	125.9 Å²	125.9	91%	0.911	65%	0.653	S	S	*	*			trans	-75.6	114.2	172.1	-76.2	179.8	-18.1	0	0	107.1	Q4	Q2-Q4 PolarHBondContact O-N 3.07Å; Q2-Q4 VanDerWaalsContact O-N 3.14Å
3	S	51.3	Low	61.4	Low	114 Å²	114	123 Å²	123	80%	0.797	64%	0.635	S	S	*	*			trans	-54.3	119.5	169.4	-175	0	0	0	0	107.4	M1 K5	M1-S3 PolarHBondContact O-N 3.48Å; S3-K5 VanDerWaalsContact C-N 3.29Å; S3-K5 PolarHBondContact O-N 3.42Å
4	Q	50.4	Low	62.1	Low	186 Å²	186	123.9 Å²	123.9	87%	0.869	65%	0.652	S	S	*	*			trans	-60.7	99	173.2	-79.9	-174.1	-42.8	0	0	106.9	Q2 Q6	Q2-Q4 PolarHBondContact O-N 3.07Å; Q2-Q4 VanDerWaalsContact O-N 3.14Å; Q4-Q6 PolarHBondContact O-N 3.03Å
5	K	63.7	Low	62.5	Low	183 Å²	183	121.3 Å²	121.3	80%	0.796	67%	0.667	S	S	*	*			trans	-61.8	111.1	173.9	-162.6	172.7	-174.9	-179.4	0	105.3	S3 V7	S3-K5 VanDerWaalsContact C-N 3.29Å; S3-K5 PolarHBondContact O-N 3.42Å; K5-V7 HydrophobicContact CB-CG2 4.43Å; K5-V7 HydrophobicContact CG-CG2 4.44Å; K5-V7 PolarHBondContact O-N 2.89Å
6	Q	58	Low	62.6	Low	165 Å²	165	118 Å²	118	77%	0.771	64%	0.644	S	S	*	*			trans	-61.9	94.6	168.8	-89	-179.1	-54.5	0	0	107	Q4 L25	Q4-Q6 PolarHBondContact O-N 3.03Å; Q6-L25 HydrophobicContact CB-CD1 3.88Å; Q6-L25 HydrophobicContact CG-CD1 4.06Å
7	V	62.3	Low	62.3	Low	127 Å²	127	118.2 Å²	118.2	77%	0.77	66%	0.656	S	S	*	*			trans	-84.8	112	172.4	175	0	0	0	0	106	K5	K5-V7 HydrophobicContact CB-CG2 4.43Å; K5-V7 HydrophobicContact CG-CG2 4.44Å; K5-V7 PolarHBondContact O-N 2.89Å
8	G	66.8	Low	61.9	Low	24 Å²	24	114.9 Å²	114.9	25%	0.247	64%	0.639	C	S	.	*			trans	-146.9	163.2	165.7	0	0	0	0	0	110.1	I10	G8-I10 PolarHBondContact O-N 2.99Å
9	T	70.1	Confident	61.6	Low	55 Å²	55	113.5 Å²	113.5	34%	0.337	64%	0.636	S	S	.	*			trans	-78.6	122.1	-177.4	-52	0	0	0	0	109.9	L11 T88	T9-L11 HydrophobicContact CG2-CD2 4.21Å; T9-L11 PolarHBondContact O-N 3.22Å; T9-T88 HydrophobicContact CG2-CG2 4.17Å
10	I	70.7	Confident	61.3	Low	103 Å²	103	114.9 Å²	114.9	53%	0.528	65%	0.65	S	S	.	*			trans	-69.4	115.4	168.1	-50.4	-63.3	0	0	0	107.7	G8 D12 L23	G8-I10 PolarHBondContact O-N 2.99Å; I10-D12 WeakPolarHBondContact CG2-O 3.41Å; I10-L23 HydrophobicContact CD1-CD2 3.8Å; I10-L23 HydrophobicContact CG2-CD2 4.45Å
11	L	71.7	Confident	61	Low	46 Å²	46	118.9 Å²	118.9	24%	0.241	66%	0.655	C	S	.	*			trans	-81.3	-24.6	-178	-55.7	-171.2	0	0	0	112.9	T9 V26	T9-L11 HydrophobicContact CG2-CD2 4.21Å; T9-L11 PolarHBondContact O-N 3.22Å; L11-V26 HydrophobicContact CD1-CG2 4.04Å; L11-V26 HydrophobicContact CD2-CG2 4.33Å
12	D	74	Confident	61.6	Low	66 Å²	66	114.6 Å²	114.6	35%	0.353	64%	0.636	S	S	.	*	S	Bend	trans	-88.5	137	-179.4	-67	-59.2	0	0	0	111.4	I10 V18	I10-D12 WeakPolarHBondContact CG2-O 3.41Å; D12-V18 HydrophobicContact CB-CG2 4.08Å
13	Q	72.3	Confident	62.2	Low	88 Å²	88	110.9 Å²	110.9	41%	0.411	62%	0.622	S	S	.	*	P	Polyproline II helix	trans	-66.6	139.6	173	-68.5	-171.6	-49.1	0	0	110.3	G15 K16	Q13-G15 PolarHBondContact O-N 2.64Å; Q13-K16 PolarHBondContact O-N 3.28Å
14	P	70.1	Confident	62.5	Low	135 Å²	135	110.2 Å²	110.2	88%	0.877	61%	0.613	S	S	*	*	T	Hydrogen-bonded Turn	trans	-53.1	135	170.7	-24.1	32.9	0	0	0	111.3
15	G	68	Low	62.8	Low	85 Å²	85	104.4 Å²	104.4	88%	0.876	59%	0.588	S	S	*	*	T	Hydrogen-bonded Turn	trans	89.2	-6	175	0	0	0	0	0	116.5	Q13 S17	Q13-G15 PolarHBondContact O-N 2.64Å; G15-S17 PolarHBondContact O-N 2.93Å
16	K	64.6	Low	62.7	Low	69 Å²	69	97.1 Å²	97.1	30%	0.3	56%	0.559	S	S	.	*	S	Bend	trans	-67	127.2	159.8	-70.9	-177.4	-177.7	173.8	0	106.7	Q13 V18 E67	Q13-K16 PolarHBondContact O-N 3.28Å; K16-V18 HydrophobicContact CB-CG2 3.91Å; K16-V18 PolarHBondContact O-N 3.37Å; K16-E67 VanDerWaalsContact NZ-CD 3.33Å; K16-E67 IonicContact NZ-OE1 3.25Å; K16-E67 PolarHBondContact NZ-OE1 3.35Å; K16-E67 IonicContact NZ-OE2 2.81Å; K16-E67 PolarHBondContact NZ-OE2 3.37Å
17	S	57.2	Low	62.8	Low	122 Å²	122	93.9 Å²	93.9	85%	0.853	55%	0.552	S	S	*	*			trans	-68.7	75.5	170.2	55.8	0	0	0	0	108.3	G15 P19	G15-S17 PolarHBondContact O-N 2.93Å; S17-P19 WeakPolarHBondContact O-CD 3.33Å
18	V	55.8	Low	62.6	Low	58 Å²	58	92 Å²	92	35%	0.352	54%	0.543	S	S	.	.			trans	-74.6	119.4	176.4	-173.4	0	0	0	0	105.6	D12 K16	D12-V18 HydrophobicContact CB-CG2 4.08Å; K16-V18 HydrophobicContact CB-CG2 3.91Å; K16-V18 PolarHBondContact O-N 3.37Å
19	P	56.9	Low	62.3	Low	88 Å²	88	93.8 Å²	93.8	57%	0.571	55%	0.55	S	S	*	.			trans	-55.1	145	167.4	23.6	-30.7	0	0	0	107.6	S17 R21	S17-P19 WeakPolarHBondContact O-CD 3.33Å; P19-R21 VanDerWaalsContact C-N 3.34Å; P19-R21 PolarHBondContact O-N 3.31Å
20	P	55.6	Low	62.7	Low	141 Å²	141	98.7 Å²	98.7	92%	0.916	57%	0.568	S	S	*	*	S	Bend	trans	-53.9	98.2	-172.5	21.7	-32.3	0	0	0	110.1
21	R	53.2	Low	63.5	Low	200 Å²	200	97.6 Å²	97.6	76%	0.755	56%	0.558	S	S	*	*			trans	-105.7	143	166	-76.9	-173	176.6	179.3	-0.2	105.9	P19 L23	P19-R21 VanDerWaalsContact C-N 3.34Å; P19-R21 PolarHBondContact O-N 3.31Å; R21-L23 PolarHBondContact O-N 3.29Å; R21-L23 VanDerWaalsContact O-N 3.15Å
22	N	58	Low	64.5	Low	156 Å²	156	100.9 Å²	100.9	83%	0.834	57%	0.572	S	S	*	*			trans	-53.9	123.2	172	-67.1	-19.6	0	0	0	108	T24	N22-T24 PolarHBondContact O-N 2.94Å
23	L	55.5	Low	65.4	Low	118 Å²	118	99.4 Å²	99.4	62%	0.618	56%	0.562	S	S	*	*			trans	-53	111.1	172.4	-73.2	161.9	0	0	0	108.1	I10 R21 L25	I10-L23 HydrophobicContact CD1-CD2 3.8Å; I10-L23 HydrophobicContact CG2-CD2 4.45Å; R21-L23 PolarHBondContact O-N 3.29Å; R21-L23 VanDerWaalsContact O-N 3.15Å; L23-L25 PolarHBondContact O-N 3.28Å
24	T	58.2	Low	66.3	Low	99 Å²	99	98.9 Å²	98.9	61%	0.607	56%	0.564	S	S	*	*			trans	-75.9	94.5	175.2	-50.7	0	0	0	0	108.1	N22 V26	N22-T24 PolarHBondContact O-N 2.94Å; T24-V26 HydrophobicContact CG2-CG2 4.34Å; T24-V26 PolarHBondContact O-N 2.89Å; T24-V26 VanDerWaalsContact O-N 3.13Å
25	L	56.3	Low	67.2	Low	65 Å²	65	92.8 Å²	92.8	34%	0.34	53%	0.526	S	S	.	.			trans	-69.3	103.4	167.1	-64.3	161.8	0	0	0	107.3	Q6 L23	Q6-L25 HydrophobicContact CB-CD1 3.88Å; Q6-L25 HydrophobicContact CG-CD1 4.06Å; L23-L25 PolarHBondContact O-N 3.28Å
26	V	62.2	Low	68.3	Low	30 Å²	30	91 Å²	91	18%	0.182	51%	0.507	C	S	.	.	P	Polyproline II helix	trans	-76.6	130.1	170.9	-175.8	0	0	0	0	107.6	L11 T24	L11-V26 HydrophobicContact CD1-CG2 4.04Å; L11-V26 HydrophobicContact CD2-CG2 4.33Å; T24-V26 HydrophobicContact CG2-CG2 4.34Å; T24-V26 PolarHBondContact O-N 2.89Å; T24-V26 VanDerWaalsContact O-N 3.13Å
27	P	58.6	Low	69.5	Low	97 Å²	97	89.5 Å²	89.5	63%	0.63	50%	0.502	S	S	*	.	P	Polyproline II helix	trans	-58.4	156.1	176	22.2	-31.9	0	0	0	111.4
28	P	58.2	Low	70.8	Confident	87 Å²	87	86.9 Å²	86.9	57%	0.565	48%	0.483	S	S	*	.	P	Polyproline II helix	trans	-54.1	144.8	-173.8	-23.9	32.5	0	0	0	112.9	H30	P28-H30 PolarHBondContact O-CD2 2.78Å; P28-H30 PolarHBondContact O-N 3.37Å
29	P	61.7	Low	72	Confident	62 Å²	62	86.7 Å²	86.7	40%	0.403	48%	0.477	S	S	.	.	P	Polyproline II helix	trans	-62.9	123.5	-175.1	25	-32.9	0	0	0	111.1	G91 E93	P29-G91 VanDerWaalsContact CA-O 3.26Å; P29-G91 WeakPolarHBondContact CA-O 3.32Å; P29-G91 WeakPolarHBondContact CB-O 3.29Å; P29-E93 HydrophobicContact CB-CG 4.41Å
30	H	77.4	Confident	73.2	Confident	157 Å²	157	83 Å²	83	73%	0.727	45%	0.453	S	S	*	.			trans	-133.6	17.7	178.4	-73.8	-47.8	0	0	0	113.4	P28 G91	P28-H30 PolarHBondContact O-CD2 2.78Å; P28-H30 PolarHBondContact O-N 3.37Å; H30-G91 PolarHBondContact N-O 3.45Å
31	R	89.1	Confident	74.4	Confident	80 Å²	80	80.9 Å²	80.9	30%	0.302	44%	0.44	S	S	.	.	B	Isolated β-bridge	trans	-130.7	158	176.4	68.2	176.5	-165	91.3	-8.8	112.7	Y90 G91 I92 E93 E117	R31-Y90 PolarHBondContact NE-O 2.75Å; R31-Y90 PolarHBondContact NH2-O 2.98Å; R31-G91 VanDerWaalsContact CG-O 3.29Å; R31-G91 WeakPolarHBondContact CG-O 3.23Å; R31-G91 PolarHBondContact N-O 2.66Å; R31-I92 WeakPolarHBondContact O-CA 3.48Å; R31-E93 PolarHBondContact O-N 3.49Å; R31-E117 IonicContact CZ-OE1 2.78Å; R31-E117 IonicContact NH1-OE1 3.91Å; R31-E117 PolarHBondContact NH1-OE1 3.49Å; R31-E117 IonicContact NH2-OE1 3.67Å; R31-E117 PolarHBondContact NH2-OE1 3.22Å
32	Q	91.9	Very high	75.6	Confident	115 Å²	115	80.1 Å²	80.1	54%	0.537	44%	0.442	S	S	.	.			trans	-93.3	169.5	172	-61	-62.2	-13.7	0	0	110.8	E93	Q32-E93 PolarHBondContact NE2-OE2 3.47Å
33	W	92.7	Very high	76.3	Confident	36 Å²	36	75.4 Å²	75.4	14%	0.136	42%	0.417	C	S	.	.			trans	-56.8	141.3	167.2	-63.3	92	0	0	0	110.6	G35 R83 M86 R87 I92 Q113 M114 E117	W33-G35 VanDerWaalsContact C-N 3.29Å; W33-G35 WeakPolarHBondContact CB-O 3.29Å; W33-G35 PolarHBondContact O-N 2.78Å; W33-R83 HydrophobicContact CH2-CG 4.15Å; W33-R83 HydrophobicContact CZ2-CG 3.96Å; W33-R83 VanDerWaalsContact CZ2-CZ 3.43Å; W33-M86 HydrophobicContact CH2-CG 4.34Å; W33-M86 HydrophobicContact CH2-SD 3.91Å; W33-M86 HydrophobicContact CZ3-CG 4.44Å; W33-M86 HydrophobicContact CZ3-SD 3.68Å; W33-R87 HydrophobicContact CH2-CG 4.05Å; W33-R87 HydrophobicContact CZ2-CG 3.48Å; W33-R87 VanDerWaalsContact CZ2-CG 3.48Å; W33-I92 HydrophobicContact CD2-CD1 4.23Å; W33-I92 HydrophobicContact CD2-CG2 3.9Å; W33-I92 HydrophobicContact CE3-CD1 3.91Å; W33-I92 HydrophobicContact CG-CG2 3.93Å; W33-I92 HydrophobicContact CH2-CD1 4.1Å; W33-I92 HydrophobicContact CZ2-CD1 4.42Å; W33-I92 HydrophobicContact CZ2-CG2 4.28Å; W33-I92 HydrophobicContact CZ3-CD1 3.84Å; W33-Q113 HydrophobicContact CD2-CG 4.43Å; W33-Q113 HydrophobicContact CE3-CG 4.2Å; W33-M114 HydrophobicContact CH2-CG 3.9Å; W33-M114 HydrophobicContact CZ3-CG 4.04Å; W33-E117 HydrophobicContact CE3-CB 3.86Å; W33-E117 HydrophobicContact CE3-CG 3.67Å; W33-E117 HydrophobicContact CZ3-CB 3.86Å; W33-E117 HydrophobicContact CZ3-CG 3.72Å
34	T	91.6	Very high	76.9	Confident	77 Å²	77	80.5 Å²	80.5	47%	0.472	43%	0.428	S	S	.	.	S	Bend	trans	-67.6	-34.3	178.2	-46.6	0	0	0	0	111.4	Y116 E117 Q120	T34-Y116 HydrophobicContact CG2-CE1 4.05Å; T34-E117 VanDerWaalsContact CB-OE2 3.23Å; T34-E117 WeakPolarHBondContact CB-OE2 3.27Å; T34-E117 PolarHBondContact N-OE2 2.82Å; T34-E117 PolarHBondContact OG1-OE1 2.99Å; T34-E117 PolarHBondContact OG1-OE2 3.43Å; T34-Q120 HydrophobicContact CG2-CG 4.05Å
35	G	88.5	Confident	77.5	Confident	6 Å²	6	81.5 Å²	81.5	6%	0.062	43%	0.43	C	S	.	.	S	Bend	trans	-118.1	150.4	176.8	0	0	0	0	0	112.3	W33 Q113	W33-G35 VanDerWaalsContact C-N 3.29Å; W33-G35 WeakPolarHBondContact CB-O 3.29Å; W33-G35 PolarHBondContact O-N 2.78Å; G35-Q113 WeakPolarHBondContact O-CG 3.5Å; G35-Q113 PolarHBondContact O-NE2 2.8Å
36	G	90.5	Very high	78.2	Confident	48 Å²	48	80.3 Å²	80.3	50%	0.495	42%	0.421	S	S	.	.			trans	-70.9	167.7	169.6	0	0	0	0	0	112.6	C38 Y39	G36-C38 PolarHBondContact O-N 2.93Å; G36-Y39 WeakPolarHBondContact O-CB 3.27Å; G36-Y39 PolarHBondContact O-N 3.1Å; G36-Y39 VanDerWaalsContact O-N 3.11Å
37	I	89.6	Confident	78.5	Confident	37 Å²	37	79.9 Å²	79.9	19%	0.19	42%	0.422	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.8	-47.5	-176.7	-62.8	166.6	0	0	0	111.1	Y39 Q102 C106 C109 I110	I37-Y39 PolarHBondContact O-N 3.42Å; I37-Y39 VanDerWaalsContact O-N 3.12Å; I37-Q102 HydrophobicContact CD1-CB 4.47Å; I37-Q102 HydrophobicContact CD1-CG 4.04Å; I37-C106 HydrophobicContact CG2-CB 4.02Å; I37-C109 HydrophobicContact CG2-CB 3.82Å; I37-C109 WeakPolarHBondContact O-CB 3.23Å; I37-I110 HydrophobicContact CB-CD1 4.26Å; I37-I110 HydrophobicContact CD1-CD1 4Å; I37-I110 HydrophobicContact CG1-CD1 3.73Å; I37-I110 HydrophobicContact CG2-CD1 3.62Å; I37-I110 HydrophobicContact CG2-CG1 4Å
38	C	85.8	Confident	78.9	Confident	68 Å²	68	78 Å²	78	46%	0.459	41%	0.41	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.8	24.6	179.2	-56	0	0	0	0	113.5	G36 C40 C41	G36-C38 PolarHBondContact O-N 2.93Å; C38-C40 PolarHBondContact O-N 3.4Å; C38-C41 HydrophobicContact CB-CB 4.3Å; C38-C41 WeakPolarHBondContact O-CB 3.33Å; C38-C41 PolarHBondContact O-N 3.49Å
39	Y	79.6	Confident	79.5	Confident	54 Å²	54	74.3 Å²	74.3	21%	0.212	39%	0.386	C	S	.	.	H	α-helix	trans	-56.6	-34.4	177	178.2	-95.3	0	0	0	112.1	G36 I37 C41 K42 N43 W46 Y116	G36-Y39 WeakPolarHBondContact O-CB 3.27Å; G36-Y39 PolarHBondContact O-N 3.1Å; G36-Y39 VanDerWaalsContact O-N 3.11Å; I37-Y39 PolarHBondContact O-N 3.42Å; I37-Y39 VanDerWaalsContact O-N 3.12Å; Y39-C41 VanDerWaalsContact C-N 3.25Å; Y39-C41 PolarHBondContact O-N 3.3Å; Y39-K42 PolarHBondContact O-N 2.96Å; Y39-K42 VanDerWaalsContact O-N 3.15Å; Y39-N43 VanDerWaalsContact CE1-ND2 3.31Å; Y39-N43 WeakPolarHBondContact CE1-ND2 3.42Å; Y39-N43 VanDerWaalsContact CE2-ND2 3.33Å; Y39-N43 WeakPolarHBondContact CE2-ND2 3.46Å; Y39-N43 PolarHBondContact O-N 3.27Å; Y39-N43 PolarHBondContact OH-ND2 3.04Å; Y39-W46 HydrophobicContact CD1-CG 4.36Å; Y39-W46 AromaticContact CE1-CD1 3.8Å; Y39-W46 HydrophobicContact CE1-CD2 4.26Å; Y39-W46 HydrophobicContact CE1-CG 4.01Å; Y39-W46 AromaticContact CE1-NE1 3.89Å; Y39-Y116 HydrophobicContact CD1-CD2 4.35Å; Y39-Y116 HydrophobicContact CD1-CG 4.23Å; Y39-Y116 HydrophobicContact CE1-CD1 4.46Å; Y39-Y116 AromaticContact CE1-CD2 3.62Å; Y39-Y116 HydrophobicContact CE1-CD2 3.62Å; Y39-Y116 AromaticContact CE1-CE2 3.82Å; Y39-Y116 HydrophobicContact CE1-CE2 3.82Å; Y39-Y116 AromaticContact CE1-CG 3.95Å; Y39-Y116 HydrophobicContact CE1-CG 3.95Å; Y39-Y116 HydrophobicContact CE2-CE1 4.48Å; Y39-Y116 HydrophobicContact CE2-CE2 4.4Å; Y39-Y116 AromaticContact CZ-CD2 3.91Å; Y39-Y116 AromaticContact CZ-CE2 3.59Å; Y39-Y116 AromaticContact CZ-CZ 3.84Å; Y39-Y116 WeakPolarHBondContact OH-CE2 3.43Å
40	C	83.1	Confident	79.9	Confident	9 Å²	9	71.6 Å²	71.6	6%	0.061	37%	0.368	C	S	.	.	H	α-helix	trans	-62.7	-26.7	174.3	60.5	0	0	0	0	113.8	C38 K42 N43 W46 G47 C112	C38-C40 PolarHBondContact O-N 3.4Å; C40-K42 VanDerWaalsContact C-N 3.28Å; C40-K42 PolarHBondContact O-N 2.87Å; C40-N43 CarbonylContact O-C 3.59Å; C40-N43 PolarHBondContact O-N 2.86Å; C40-W46 HydrophobicContact CB-CB 4.16Å; C40-G47 PolarHBondContact O-N 3.23Å; C40-C112 HydrophobicContact CB-CB 3.81Å
41	C	80.8	Confident	79.6	Confident	97 Å²	97	69.7 Å²	69.7	66%	0.655	37%	0.368	S	S	*	.	H	α-helix	trans	-73.3	-24	176.9	-54.3	0	0	0	0	112.3	C38 Y39	C38-C41 HydrophobicContact CB-CB 4.3Å; C38-C41 WeakPolarHBondContact O-CB 3.33Å; C38-C41 PolarHBondContact O-N 3.49Å; Y39-C41 VanDerWaalsContact C-N 3.25Å; Y39-C41 PolarHBondContact O-N 3.3Å
42	K	77.6	Confident	78.9	Confident	184 Å²	184	70.3 Å²	70.3	80%	0.8	38%	0.383	S	S	*	.	H	α-helix	trans	-87.1	-22.9	177.3	-62.9	-173.9	178.8	-174.9	0	112.5	Y39 C40	Y39-K42 PolarHBondContact O-N 2.96Å; Y39-K42 VanDerWaalsContact O-N 3.15Å; C40-K42 VanDerWaalsContact C-N 3.28Å; C40-K42 PolarHBondContact O-N 2.87Å
43	N	72.6	Confident	78.3	Confident	58 Å²	58	65.2 Å²	65.2	31%	0.31	36%	0.36	S	S	.	.			trans	-123.2	106.4	-179.3	-66.3	-68.4	0	0	0	110.9	Y39 C40 D45 W46 G47	Y39-N43 VanDerWaalsContact CE1-ND2 3.31Å; Y39-N43 WeakPolarHBondContact CE1-ND2 3.42Å; Y39-N43 VanDerWaalsContact CE2-ND2 3.33Å; Y39-N43 WeakPolarHBondContact CE2-ND2 3.46Å; Y39-N43 PolarHBondContact O-N 3.27Å; Y39-N43 PolarHBondContact OH-ND2 3.04Å; C40-N43 CarbonylContact O-C 3.59Å; C40-N43 PolarHBondContact O-N 2.86Å; N43-D45 PolarHBondContact O-N 3.42Å; N43-D45 VanDerWaalsContact O-N 3.16Å; N43-W46 HydrophobicContact CB-CB 4.16Å; N43-W46 HydrophobicContact CB-CG 4.2Å; N43-W46 WeakPolarHBondContact O-CB 3.34Å; N43-W46 PolarHBondContact O-N 3.19Å; N43-G47 PolarHBondContact O-N 2.95Å
44	R	69.1	Low	77.8	Confident	225 Å²	225	64.9 Å²	64.9	85%	0.849	36%	0.359	S	S	*	.	H	α-helix	trans	-54.7	-37.3	-175.5	-171.1	-179.7	-68.8	-168.7	-0.8	113.1	W46 G47 C48	R44-W46 VanDerWaalsContact C-N 3.34Å; R44-W46 PolarHBondContact O-N 3.31Å; R44-G47 PolarHBondContact O-N 2.76Å; R44-C48 WeakPolarHBondContact O-CB 3.31Å; R44-C48 PolarHBondContact O-N 3.47Å
45	D	70.5	Confident	77.3	Confident	120 Å²	120	65.9 Å²	65.9	64%	0.642	36%	0.357	S	S	*	.	H	α-helix	trans	-63.1	-41.3	179	-58.8	-30.3	0	0	0	111.9	N43 F49	N43-D45 PolarHBondContact O-N 3.42Å; N43-D45 VanDerWaalsContact O-N 3.16Å; D45-F49 WeakPolarHBondContact O-CB 3.18Å; D45-F49 PolarHBondContact O-N 3.15Å
46	W	71.8	Confident	77	Confident	40 Å²	40	66 Å²	66	15%	0.152	36%	0.357	C	S	.	.	H	α-helix	trans	-69.6	-42.1	176.5	-73.5	92.4	0	0	0	111.6	Y39 C40 N43 R44 F49 A50 C112 H115 Y116 Q119	Y39-W46 HydrophobicContact CD1-CG 4.36Å; Y39-W46 AromaticContact CE1-CD1 3.8Å; Y39-W46 HydrophobicContact CE1-CD2 4.26Å; Y39-W46 HydrophobicContact CE1-CG 4.01Å; Y39-W46 AromaticContact CE1-NE1 3.89Å; C40-W46 HydrophobicContact CB-CB 4.16Å; N43-W46 HydrophobicContact CB-CB 4.16Å; N43-W46 HydrophobicContact CB-CG 4.2Å; N43-W46 WeakPolarHBondContact O-CB 3.34Å; N43-W46 PolarHBondContact O-N 3.19Å; R44-W46 VanDerWaalsContact C-N 3.34Å; R44-W46 PolarHBondContact O-N 3.31Å; W46-F49 PolarHBondContact O-N 3.48Å; W46-A50 PolarHBondContact O-N 3.16Å; W46-C112 PolarHBondContact O-SG 3.45Å; W46-H115 AromaticContact CH2-ND1 3.41Å; W46-H115 WeakPolarHBondContact CH2-ND1 3.41Å; W46-H115 HydrophobicContact CZ3-CB 4.12Å; W46-H115 AromaticContact CZ3-ND1 3.16Å; W46-H115 WeakPolarHBondContact CZ3-ND1 3.4Å; W46-Y116 HydrophobicContact CH2-CD2 4.13Å; W46-Y116 AromaticContact CZ2-CD2 3.73Å; W46-Y116 HydrophobicContact CZ2-CD2 3.73Å; W46-Q119 HydrophobicContact CH2-CG 4.45Å
47	G	68.4	Low	76.7	Confident	20 Å²	20	63.8 Å²	63.8	21%	0.206	33%	0.334	C	S	.	.	H	α-helix	trans	-58.8	-45.6	174.3	0	0	0	0	0	112.9	C40 N43 R44 A50 V51	C40-G47 PolarHBondContact O-N 3.23Å; N43-G47 PolarHBondContact O-N 2.95Å; R44-G47 PolarHBondContact O-N 2.76Å; G47-A50 WeakPolarHBondContact O-CB 3.37Å; G47-A50 PolarHBondContact O-N 3.46Å; G47-V51 WeakPolarHBondContact O-CG2 2.88Å; G47-V51 PolarHBondContact O-N 3.32Å
48	C	66.9	Low	76.5	Confident	57 Å²	57	62.1 Å²	62.1	39%	0.385	33%	0.325	S	S	.	.	H	α-helix	trans	-63.1	-45.2	175.7	-172.2	0	0	0	0	111.3	R44 A50 V51 C52	R44-C48 WeakPolarHBondContact O-CB 3.31Å; R44-C48 PolarHBondContact O-N 3.47Å; C48-A50 VanDerWaalsContact C-N 3.3Å; C48-A50 PolarHBondContact O-N 2.99Å; C48-V51 PolarHBondContact O-N 3.04Å; C48-V51 VanDerWaalsContact O-N 3.15Å; C48-C52 VanDerWaalsContact O-CB 3.27Å; C48-C52 WeakPolarHBondContact O-CB 3.45Å; C48-C52 PolarHBondContact O-N 3.01Å
49	F	69.3	Low	76.5	Confident	10 Å²	10	59.9 Å²	59.9	4%	0.044	31%	0.309	C	S	.	.	H	α-helix	trans	-62.8	-36.4	178.6	-165.5	-121.1	0	0	0	112.5	D45 W46 V51 C53 L57 H115 C129 A132	D45-F49 WeakPolarHBondContact O-CB 3.18Å; D45-F49 PolarHBondContact O-N 3.15Å; W46-F49 PolarHBondContact O-N 3.48Å; F49-V51 VanDerWaalsContact C-N 3.33Å; F49-V51 PolarHBondContact O-N 2.91Å; F49-C53 HydrophobicContact CD2-CB 3.53Å; F49-C53 HydrophobicContact CE2-CB 3.59Å; F49-C53 HydrophobicContact CG-CB 4.41Å; F49-C53 CarbonylContact O-C 3.45Å; F49-C53 WeakPolarHBondContact O-CA 3.44Å; F49-C53 PolarHBondContact O-N 3.32Å; F49-L57 HydrophobicContact CD1-CB 4.3Å; F49-L57 HydrophobicContact CD1-CD1 3.82Å; F49-L57 HydrophobicContact CD1-CG 4.27Å; F49-L57 HydrophobicContact CE1-CB 3.78Å; F49-L57 HydrophobicContact CE1-CD1 4Å; F49-L57 HydrophobicContact CE1-CG 3.92Å; F49-L57 HydrophobicContact CZ-CB 4.2Å; F49-H115 AromaticContact CE1-CE1 3.67Å; F49-H115 AromaticContact CE1-NE2 3.66Å; F49-C129 HydrophobicContact CD2-CB 4.49Å; F49-A132 HydrophobicContact CD2-CB 4.45Å; F49-A132 HydrophobicContact CE2-CB 3.5Å; F49-A132 VanDerWaalsContact CE2-CB 3.5Å; F49-A132 HydrophobicContact CZ-CB 3.82Å
50	A	70.6	Confident	76.8	Confident	5 Å²	5	59 Å²	59	4%	0.041	31%	0.307	C	S	.	.	H	α-helix	trans	-58.3	-42.6	173.2	0	0	0	0	0	112.8	W46 G47 C48 Y54 C112	W46-A50 PolarHBondContact O-N 3.16Å; G47-A50 WeakPolarHBondContact O-CB 3.37Å; G47-A50 PolarHBondContact O-N 3.46Å; C48-A50 VanDerWaalsContact C-N 3.3Å; C48-A50 PolarHBondContact O-N 2.99Å; A50-Y54 VanDerWaalsContact O-CB 3.26Å; A50-Y54 WeakPolarHBondContact O-CB 3.45Å; A50-Y54 VanDerWaalsContact O-CD2 3.29Å; A50-Y54 WeakPolarHBondContact O-CD2 3.12Å; A50-C112 VanDerWaalsContact CA-SG 3.58Å; A50-C112 HydrophobicContact CB-CB 4.48Å; A50-C112 WeakPolarHBondContact CB-SG 3.21Å
51	V	71	Confident	77	Confident	118 Å²	118	58.6 Å²	58.6	72%	0.715	30%	0.304	S	S	*	.	H	α-helix	trans	-94.8	-50.7	-168.2	177	0	0	0	0	110.8	G47 C48 F49	G47-V51 WeakPolarHBondContact O-CG2 2.88Å; G47-V51 PolarHBondContact O-N 3.32Å; C48-V51 PolarHBondContact O-N 3.04Å; C48-V51 VanDerWaalsContact O-N 3.15Å; F49-V51 VanDerWaalsContact C-N 3.33Å; F49-V51 PolarHBondContact O-N 2.91Å
52	C	74.6	Confident	77.4	Confident	93 Å²	93	54 Å²	54	63%	0.628	27%	0.273	S	S	*	.	H	α-helix	trans	-79.9	-27.6	-174.2	-59.4	0	0	0	0	113	C48	C48-C52 VanDerWaalsContact O-CB 3.27Å; C48-C52 WeakPolarHBondContact O-CB 3.45Å; C48-C52 PolarHBondContact O-N 3.01Å
53	C	79.5	Confident	77.9	Confident	7 Å²	7	51.6 Å²	51.6	5%	0.047	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	-123.9	27.7	-175	-60.2	0	0	0	0	112.3	F49 F55 C56 L57	F49-C53 HydrophobicContact CD2-CB 3.53Å; F49-C53 HydrophobicContact CE2-CB 3.59Å; F49-C53 HydrophobicContact CG-CB 4.41Å; F49-C53 CarbonylContact O-C 3.45Å; F49-C53 WeakPolarHBondContact O-CA 3.44Å; F49-C53 PolarHBondContact O-N 3.32Å; C53-F55 PolarHBondContact O-N 3.27Å; C53-C56 HydrophobicContact CB-CB 4.17Å; C53-C56 WeakPolarHBondContact O-CA 3.35Å; C53-C56 VanDerWaalsContact O-CB 3.23Å; C53-C56 WeakPolarHBondContact O-CB 3.32Å; C53-C56 PolarHBondContact O-N 2.95Å; C53-L57 PolarHBondContact O-N 3.18Å
54	Y	81.6	Confident	78.6	Confident	30 Å²	30	50 Å²	50	12%	0.118	26%	0.258	C	S	.	.	H	α-helix	trans	-50.3	-51.6	-171.9	-175.4	-106.5	0	0	0	114	A50 C56 L57 L58 P75 N107 A111	A50-Y54 VanDerWaalsContact O-CB 3.26Å; A50-Y54 WeakPolarHBondContact O-CB 3.45Å; A50-Y54 VanDerWaalsContact O-CD2 3.29Å; A50-Y54 WeakPolarHBondContact O-CD2 3.12Å; Y54-C56 VanDerWaalsContact C-N 3.29Å; Y54-C56 PolarHBondContact O-N 2.88Å; Y54-L57 WeakPolarHBondContact O-CB 3.26Å; Y54-L57 PolarHBondContact O-N 3.23Å; Y54-L58 HydrophobicContact CD1-CD1 4.15Å; Y54-L58 HydrophobicContact CD1-CG 4.41Å; Y54-L58 HydrophobicContact CE1-CD1 3.4Å; Y54-L58 HydrophobicContact CE1-CG 3.91Å; Y54-L58 HydrophobicContact CE2-CD2 4.42Å; Y54-L58 HydrophobicContact CE2-CG 4.41Å; Y54-L58 PolarHBondContact O-N 2.94Å; Y54-P75 HydrophobicContact CE1-CB 3.61Å; Y54-P75 PolarHBondContact OH-O 3.24Å; Y54-N107 WeakPolarHBondContact CE2-OD1 3.27Å; Y54-N107 PolarHBondContact OH-OD1 2.93Å; Y54-A111 HydrophobicContact CD2-CB 4.33Å; Y54-A111 HydrophobicContact CE2-CB 3.62Å
55	F	81.8	Confident	79.4	Confident	98 Å²	98	39.7 Å²	39.7	43%	0.43	22%	0.219	S	C	.	.	H	α-helix	trans	-66.7	-30.4	179.6	-68.6	-73.4	0	0	0	113.4	C53 L58 N59 P72 Y140	C53-F55 PolarHBondContact O-N 3.27Å; F55-L58 PolarHBondContact O-N 3.28Å; F55-N59 WeakPolarHBondContact O-CB 3.43Å; F55-N59 PolarHBondContact O-N 3.14Å; F55-P72 WeakPolarHBondContact CD1-O 3.37Å; F55-P72 WeakPolarHBondContact CE1-O 3.34Å; F55-Y140 HydrophobicContact CB-CE2 4.39Å; F55-Y140 WeakPolarHBondContact CB-OH 3.36Å
56	C	81.3	Confident	80.2	Confident	9 Å²	9	39.9 Å²	39.9	6%	0.061	22%	0.22	C	C	.	.	H	α-helix	trans	-66.8	-45.7	175.8	-56.3	0	0	0	0	110.3	C53 Y54 N59 Q60 C136	C53-C56 HydrophobicContact CB-CB 4.17Å; C53-C56 WeakPolarHBondContact O-CA 3.35Å; C53-C56 VanDerWaalsContact O-CB 3.23Å; C53-C56 WeakPolarHBondContact O-CB 3.32Å; C53-C56 PolarHBondContact O-N 2.95Å; Y54-C56 VanDerWaalsContact C-N 3.29Å; Y54-C56 PolarHBondContact O-N 2.88Å; C56-N59 PolarHBondContact O-N 2.81Å; C56-Q60 WeakPolarHBondContact O-CG 3.25Å; C56-Q60 PolarHBondContact O-N 2.79Å; C56-C136 HydrophobicContact CB-CB 3.41Å; C56-C136 VanDerWaalsContact CB-CB 3.41Å; C56-C136 WeakPolarHBondContact SG-CB 3.36Å
57	L	84.1	Confident	80.8	Confident	0 Å²	0	38.9 Å²	38.9	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-57.6	-48.9	173.7	-177.6	167.7	0	0	0	110.4	F49 C53 Y54 N59 Q60 L61 A111 H115	F49-L57 HydrophobicContact CD1-CB 4.3Å; F49-L57 HydrophobicContact CD1-CD1 3.82Å; F49-L57 HydrophobicContact CD1-CG 4.27Å; F49-L57 HydrophobicContact CE1-CB 3.78Å; F49-L57 HydrophobicContact CE1-CD1 4Å; F49-L57 HydrophobicContact CE1-CG 3.92Å; F49-L57 HydrophobicContact CZ-CB 4.2Å; C53-L57 PolarHBondContact O-N 3.18Å; Y54-L57 WeakPolarHBondContact O-CB 3.26Å; Y54-L57 PolarHBondContact O-N 3.23Å; L57-N59 VanDerWaalsContact C-N 3.32Å; L57-N59 PolarHBondContact O-N 2.98Å; L57-Q60 PolarHBondContact O-N 2.99Å; L57-L61 HydrophobicContact CD2-CD1 3.44Å; L57-L61 VanDerWaalsContact CD2-CD1 3.44Å; L57-L61 HydrophobicContact CD2-CG 4Å; L57-L61 PolarHBondContact O-N 3.15Å; L57-A111 HydrophobicContact CD1-CB 4.42Å; L57-A111 HydrophobicContact CD2-CB 3.79Å; L57-H115 HydrophobicContact CD1-CB 4.01Å; L57-H115 HydrophobicContact CD2-CB 3.98Å; L57-H115 HydrophobicContact CG-CB 3.82Å
58	L	86.6	Confident	81.3	Confident	2 Å²	2	45.2 Å²	45.2	1%	0.01	24%	0.239	C	C	.	.	H	α-helix	trans	-60.3	-40.6	177.7	-70.2	-168.1	0	0	0	112.7	Y54 F55 L61 T62 P72 P75 L79 A111	Y54-L58 HydrophobicContact CD1-CD1 4.15Å; Y54-L58 HydrophobicContact CD1-CG 4.41Å; Y54-L58 HydrophobicContact CE1-CD1 3.4Å; Y54-L58 HydrophobicContact CE1-CG 3.91Å; Y54-L58 HydrophobicContact CE2-CD2 4.42Å; Y54-L58 HydrophobicContact CE2-CG 4.41Å; Y54-L58 PolarHBondContact O-N 2.94Å; F55-L58 PolarHBondContact O-N 3.28Å; L58-L61 PolarHBondContact O-N 3.13Å; L58-T62 VanDerWaalsContact O-CB 3.28Å; L58-T62 WeakPolarHBondContact O-CB 3.37Å; L58-T62 PolarHBondContact O-N 2.68Å; L58-T62 PolarHBondContact O-OG1 3.09Å; L58-P72 HydrophobicContact CB-CB 4.05Å; L58-P72 HydrophobicContact CB-CG 4.07Å; L58-P75 HydrophobicContact CD1-CB 4.18Å; L58-L79 HydrophobicContact CD2-CD1 3.77Å; L58-L79 HydrophobicContact CD2-CD2 4.25Å; L58-L79 HydrophobicContact CD2-CG 4.47Å; L58-A111 HydrophobicContact CD2-CB 4.41Å
59	N	84.8	Confident	81.4	Confident	22 Å²	22	46.8 Å²	46.8	12%	0.118	25%	0.247	C	C	.	.	H	α-helix	trans	-63.5	-42.9	176.6	-174.2	37.7	0	0	0	111.4	F55 C56 L57 T62 K63 P72	F55-N59 WeakPolarHBondContact O-CB 3.43Å; F55-N59 PolarHBondContact O-N 3.14Å; C56-N59 PolarHBondContact O-N 2.81Å; L57-N59 VanDerWaalsContact C-N 3.32Å; L57-N59 PolarHBondContact O-N 2.98Å; N59-T62 PolarHBondContact O-N 2.87Å; N59-K63 WeakPolarHBondContact O-CB 3.34Å; N59-K63 WeakPolarHBondContact O-CG 3.49Å; N59-K63 PolarHBondContact O-N 3.23Å; N59-K63 WeakPolarHBondContact OD1-CE 3.45Å; N59-P72 HydrophobicContact CB-CG 4.36Å
60	Q	86	Confident	81.8	Confident	36 Å²	36	49.8 Å²	49.8	17%	0.168	27%	0.268	C	S	.	.	H	α-helix	trans	-62.6	-44.9	175.7	-69.6	179	21.2	0	0	111.6	C56 L57 T62 K63 A64 H115 I124 C136	C56-Q60 WeakPolarHBondContact O-CG 3.25Å; C56-Q60 PolarHBondContact O-N 2.79Å; L57-Q60 PolarHBondContact O-N 2.99Å; Q60-T62 VanDerWaalsContact C-N 3.35Å; Q60-T62 PolarHBondContact O-N 3.45Å; Q60-K63 PolarHBondContact O-N 3.09Å; Q60-A64 VanDerWaalsContact O-CB 3.28Å; Q60-A64 WeakPolarHBondContact O-CB 3.28Å; Q60-A64 PolarHBondContact O-N 2.86Å; Q60-H115 PolarHBondContact OE1-NE2 3.22Å; Q60-I124 HydrophobicContact CB-CD1 4.16Å; Q60-C136 PolarHBondContact NE2-SG 3.03Å; Q60-C136 VanDerWaalsContact NE2-SG 3.45Å
61	L	89.1	Confident	82	Confident	0 Å²	0	51.6 Å²	51.6	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-59.4	-45.5	174.5	-79.1	177.8	0	0	0	112.1	L57 L58 K63 A64 M65 L79 M86 M114 H115 A118 I124	L57-L61 HydrophobicContact CD2-CD1 3.44Å; L57-L61 VanDerWaalsContact CD2-CD1 3.44Å; L57-L61 HydrophobicContact CD2-CG 4Å; L57-L61 PolarHBondContact O-N 3.15Å; L58-L61 PolarHBondContact O-N 3.13Å; L61-K63 PolarHBondContact O-N 2.99Å; L61-A64 PolarHBondContact O-N 3.03Å; L61-M65 WeakPolarHBondContact O-CB 3.48Å; L61-M65 VanDerWaalsContact O-CG 3.27Å; L61-M65 WeakPolarHBondContact O-CG 3.36Å; L61-M65 PolarHBondContact O-N 2.97Å; L61-L79 HydrophobicContact CD1-CD1 4.27Å; L61-M86 HydrophobicContact CD2-CE 4Å; L61-M114 HydrophobicContact CD1-CB 3.92Å; L61-M114 HydrophobicContact CD1-CE 4.38Å; L61-M114 HydrophobicContact CD2-CB 4.12Å; L61-H115 HydrophobicContact CD2-CB 4.36Å; L61-H115 HydrophobicContact CG-CB 4.46Å; L61-A118 HydrophobicContact CD2-CB 4.1Å; L61-I124 HydrophobicContact CD2-CD1 4Å; L61-I124 HydrophobicContact CG-CD1 4.49Å
62	T	89	Confident	82	Confident	1 Å²	1	46.2 Å²	46.2	1%	0.006	24%	0.242	C	C	.	.	H	α-helix	trans	-62.7	-44.3	-179	-60.8	0	0	0	0	111.4	L58 N59 Q60 M65 N66 E67 K68 Y71 P72	L58-T62 VanDerWaalsContact O-CB 3.28Å; L58-T62 WeakPolarHBondContact O-CB 3.37Å; L58-T62 PolarHBondContact O-N 2.68Å; L58-T62 PolarHBondContact O-OG1 3.09Å; N59-T62 PolarHBondContact O-N 2.87Å; Q60-T62 VanDerWaalsContact C-N 3.35Å; Q60-T62 PolarHBondContact O-N 3.45Å; T62-M65 CarbonylContact O-C 3.36Å; T62-M65 PolarHBondContact O-N 2.93Å; T62-N66 PolarHBondContact O-N 2.99Å; T62-E67 HydrophobicContact CG2-CB 4.01Å; T62-E67 VanDerWaalsContact CG2-O 3.29Å; T62-E67 WeakPolarHBondContact CG2-O 3.45Å; T62-E67 PolarHBondContact O-N 3.36Å; T62-K68 WeakPolarHBondContact CG2-O 3.25Å; T62-Y71 HydrophobicContact CG2-CD2 4.39Å; T62-P72 WeakPolarHBondContact OG1-CD 3.38Å
63	K	86.4	Confident	82.1	Confident	132 Å²	132	46.3 Å²	46.3	57%	0.574	24%	0.243	S	C	*	.	H	α-helix	trans	-63.9	-45.1	174.2	-72.8	178.1	179.7	-176.9	0	112	N59 Q60 L61 M65 N66	N59-K63 WeakPolarHBondContact O-CB 3.34Å; N59-K63 WeakPolarHBondContact O-CG 3.49Å; N59-K63 PolarHBondContact O-N 3.23Å; N59-K63 WeakPolarHBondContact OD1-CE 3.45Å; Q60-K63 PolarHBondContact O-N 3.09Å; L61-K63 PolarHBondContact O-N 2.99Å; K63-M65 PolarHBondContact O-N 2.8Å; K63-N66 PolarHBondContact O-N 2.93Å
64	A	87.7	Confident	81.9	Confident	26 Å²	26	50.9 Å²	50.9	22%	0.215	27%	0.266	C	S	.	.	H	α-helix	trans	-61.4	-32.3	178	0	0	0	0	0	112.6	Q60 L61 N66 V123 I124	Q60-A64 VanDerWaalsContact O-CB 3.28Å; Q60-A64 WeakPolarHBondContact O-CB 3.28Å; Q60-A64 PolarHBondContact O-N 2.86Å; L61-A64 PolarHBondContact O-N 3.03Å; A64-N66 VanDerWaalsContact C-N 3.31Å; A64-V123 HydrophobicContact CB-CB 4.37Å; A64-V123 HydrophobicContact CB-CG2 4.12Å; A64-I124 HydrophobicContact CB-CD1 3.84Å; A64-I124 HydrophobicContact CB-CG1 3.5Å; A64-I124 VanDerWaalsContact CB-CG1 3.5Å
65	M	87.3	Confident	81.4	Confident	7 Å²	7	51.7 Å²	51.7	3%	0.034	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.6	5.2	175.8	-63.7	-54.8	-61.8	0	0	113.6	L61 T62 K63 E67 L82 K85 M86 Y90	L61-M65 WeakPolarHBondContact O-CB 3.48Å; L61-M65 VanDerWaalsContact O-CG 3.27Å; L61-M65 WeakPolarHBondContact O-CG 3.36Å; L61-M65 PolarHBondContact O-N 2.97Å; T62-M65 CarbonylContact O-C 3.36Å; T62-M65 PolarHBondContact O-N 2.93Å; K63-M65 PolarHBondContact O-N 2.8Å; M65-E67 VanDerWaalsContact C-N 3.25Å; M65-E67 HydrophobicContact CB-CG 4.42Å; M65-E67 PolarHBondContact O-N 3.49Å; M65-L82 HydrophobicContact CB-CD2 3.97Å; M65-L82 HydrophobicContact CG-CD2 4.2Å; M65-K85 HydrophobicContact CB-CD 4.43Å; M65-K85 HydrophobicContact CE-CB 3.98Å; M65-K85 HydrophobicContact CE-CD 3.73Å; M65-K85 HydrophobicContact CE-CG 3.53Å; M65-K85 PolarHBondContact O-NZ 3.48Å; M65-M86 HydrophobicContact CE-CB 4.08Å; M65-M86 HydrophobicContact SD-CB 4.21Å; M65-M86 HydrophobicContact SD-CE 4.07Å; M65-Y90 HydrophobicContact CE-CE2 4.13Å; M65-Y90 HydrophobicContact SD-CE2 3.81Å
66	N	85.8	Confident	81.1	Confident	125 Å²	125	52.4 Å²	52.4	67%	0.668	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.1	43	-176.3	-165.1	34	0	0	0	112.9	T62 K63 A64	T62-N66 PolarHBondContact O-N 2.99Å; K63-N66 PolarHBondContact O-N 2.93Å; A64-N66 VanDerWaalsContact C-N 3.31Å
67	E	85.3	Confident	81.1	Confident	18 Å²	18	55.7 Å²	55.7	8%	0.084	30%	0.297	C	S	.	.			trans	-111.5	165.3	176.2	-72.4	-55.8	158	0	0	112.5	K16 T62 M65 Y71 L82 K85	K16-E67 VanDerWaalsContact NZ-CD 3.33Å; K16-E67 IonicContact NZ-OE1 3.25Å; K16-E67 PolarHBondContact NZ-OE1 3.35Å; K16-E67 IonicContact NZ-OE2 2.81Å; K16-E67 PolarHBondContact NZ-OE2 3.37Å; T62-E67 HydrophobicContact CG2-CB 4.01Å; T62-E67 VanDerWaalsContact CG2-O 3.29Å; T62-E67 WeakPolarHBondContact CG2-O 3.45Å; T62-E67 PolarHBondContact O-N 3.36Å; M65-E67 VanDerWaalsContact C-N 3.25Å; M65-E67 HydrophobicContact CB-CG 4.42Å; M65-E67 PolarHBondContact O-N 3.49Å; E67-Y71 HydrophobicContact CB-CD2 3.85Å; E67-Y71 HydrophobicContact CB-CE2 3.69Å; E67-Y71 HydrophobicContact CG-CE2 3.97Å; E67-L82 HydrophobicContact CB-CD2 4.13Å; E67-L82 HydrophobicContact CG-CD2 4.05Å; E67-K85 HydrophobicContact CG-CD 4.15Å; E67-K85 IonicContact OE1-NZ 3.71Å; E67-K85 PolarHBondContact OE1-NZ 3.34Å
68	K	78.3	Confident	81.2	Confident	153 Å²	153	55.9 Å²	55.9	67%	0.665	30%	0.299	S	S	*	.			trans	-75.9	150.8	-176.9	-68	-165	177.4	-174.1	0	112.5	T62 C70 Y71	T62-K68 WeakPolarHBondContact CG2-O 3.25Å; K68-C70 PolarHBondContact O-N 2.93Å; K68-Y71 VanDerWaalsContact O-CD2 3.29Å; K68-Y71 WeakPolarHBondContact O-CD2 3.16Å; K68-Y71 PolarHBondContact O-N 3.3Å
69	T	69.2	Low	81.3	Confident	90 Å²	90	55.9 Å²	55.9	55%	0.552	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64	2.1	179.2	-35	0	0	0	0	115.4	Y71 P72	T69-Y71 VanDerWaalsContact C-N 3.29Å; T69-P72 HydrophobicContact CG2-CG 4.47Å; T69-P72 VanDerWaalsContact O-CD 3.27Å; T69-P72 WeakPolarHBondContact O-CD 3.07Å
70	C	78.1	Confident	81.7	Confident	74 Å²	74	56 Å²	56	50%	0.5	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.7	-23.6	172.2	58.9	0	0	0	0	113.1	K68 C73 L74	K68-C70 PolarHBondContact O-N 2.93Å; C70-C73 WeakPolarHBondContact O-CB 3.27Å; C70-C73 PolarHBondContact O-N 3.41Å; C70-C73 VanDerWaalsContact O-N 3.07Å; C70-L74 PolarHBondContact O-N 3.12Å
71	Y	75.3	Confident	81.9	Confident	43 Å²	43	55.6 Å²	55.6	17%	0.169	31%	0.306	C	S	.	.	G	3₁₀ helix	trans	-58.6	-45.4	178.9	-80.2	-90.4	0	0	0	113	T62 E67 K68 T69 C73 L74 G78 L82	T62-Y71 HydrophobicContact CG2-CD2 4.39Å; E67-Y71 HydrophobicContact CB-CD2 3.85Å; E67-Y71 HydrophobicContact CB-CE2 3.69Å; E67-Y71 HydrophobicContact CG-CE2 3.97Å; K68-Y71 VanDerWaalsContact O-CD2 3.29Å; K68-Y71 WeakPolarHBondContact O-CD2 3.16Å; K68-Y71 PolarHBondContact O-N 3.3Å; T69-Y71 VanDerWaalsContact C-N 3.29Å; Y71-C73 PolarHBondContact O-N 3.29Å; Y71-L74 CarbonylContact O-C 3.49Å; Y71-L74 PolarHBondContact O-N 2.88Å; Y71-L74 VanDerWaalsContact O-N 3.13Å; Y71-G78 VanDerWaalsContact CD1-CA 3.44Å; Y71-G78 WeakPolarHBondContact CD1-O 3.22Å; Y71-L82 HydrophobicContact CD1-CD1 4.12Å; Y71-L82 HydrophobicContact CD1-CD2 4.13Å; Y71-L82 HydrophobicContact CD1-CG 3.67Å; Y71-L82 HydrophobicContact CE1-CD2 4.33Å; Y71-L82 HydrophobicContact CE1-CG 4.1Å; Y71-L82 HydrophobicContact CG-CD1 4.28Å; Y71-L82 HydrophobicContact CG-CD2 4.32Å; Y71-L82 HydrophobicContact CG-CG 4.15Å
72	P	70.6	Confident	82	Confident	4 Å²	4	55.7 Å²	55.7	3%	0.026	31%	0.307	C	S	.	.	G	3₁₀ helix	trans	-56.6	-29.4	171.5	-29.2	32.6	0	0	0	115.4	F55 L58 N59 T62 T69 L74	F55-P72 WeakPolarHBondContact CD1-O 3.37Å; F55-P72 WeakPolarHBondContact CE1-O 3.34Å; L58-P72 HydrophobicContact CB-CB 4.05Å; L58-P72 HydrophobicContact CB-CG 4.07Å; N59-P72 HydrophobicContact CB-CG 4.36Å; T62-P72 WeakPolarHBondContact OG1-CD 3.38Å; T69-P72 HydrophobicContact CG2-CG 4.47Å; T69-P72 VanDerWaalsContact O-CD 3.27Å; T69-P72 WeakPolarHBondContact O-CD 3.07Å; P72-L74 VanDerWaalsContact C-N 3.28Å; P72-L74 PolarHBondContact O-N 3.11Å
73	C	75.5	Confident	82.2	Confident	96 Å²	96	55.7 Å²	55.7	65%	0.649	31%	0.306	S	S	*	.	G	3₁₀ helix	trans	-75.1	-19.3	179.5	-56.7	0	0	0	0	112.9	C70 Y71 P75	C70-C73 WeakPolarHBondContact O-CB 3.27Å; C70-C73 PolarHBondContact O-N 3.41Å; C70-C73 VanDerWaalsContact O-N 3.07Å; Y71-C73 PolarHBondContact O-N 3.29Å; C73-P75 VanDerWaalsContact C-CD 3.49Å; C73-P75 VanDerWaalsContact O-CD 3.3Å; C73-P75 WeakPolarHBondContact O-CD 3.43Å
74	L	75.6	Confident	82.4	Confident	103 Å²	103	53.6 Å²	53.6	54%	0.539	30%	0.3	S	S	.	.	S	Bend	trans	-116.3	72.1	177.9	-63.9	175.7	0	0	0	108.9	C70 Y71 P72 W76 C77 G78	C70-L74 PolarHBondContact O-N 3.12Å; Y71-L74 CarbonylContact O-C 3.49Å; Y71-L74 PolarHBondContact O-N 2.88Å; Y71-L74 VanDerWaalsContact O-N 3.13Å; P72-L74 VanDerWaalsContact C-N 3.28Å; P72-L74 PolarHBondContact O-N 3.11Å; L74-W76 PolarHBondContact O-N 2.91Å; L74-C77 HydrophobicContact CB-CB 4.48Å; L74-C77 PolarHBondContact O-N 2.85Å; L74-G78 WeakPolarHBondContact O-CA 3.29Å; L74-G78 PolarHBondContact O-N 3.4Å
75	P	72.1	Confident	82.5	Confident	47 Å²	47	54 Å²	54	31%	0.305	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-25.4	-163.7	25.3	-37.3	0	0	0	114.3	Y54 L58 C73 L79 N107	Y54-P75 HydrophobicContact CE1-CB 3.61Å; Y54-P75 PolarHBondContact OH-O 3.24Å; L58-P75 HydrophobicContact CD1-CB 4.18Å; C73-P75 VanDerWaalsContact C-CD 3.49Å; C73-P75 VanDerWaalsContact O-CD 3.3Å; C73-P75 WeakPolarHBondContact O-CD 3.43Å; P75-L79 VanDerWaalsContact O-CB 3.26Å; P75-L79 WeakPolarHBondContact O-CB 3.12Å; P75-N107 PolarHBondContact O-ND2 3.27Å; P75-N107 VanDerWaalsContact O-ND2 3.15Å
76	W	76.3	Confident	82.7	Confident	113 Å²	113	53.6 Å²	53.6	43%	0.428	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.3	-64.2	174.9	-176.1	55.4	0	0	0	111.8	L74 G78 L79 V80 C104	L74-W76 PolarHBondContact O-N 2.91Å; W76-G78 VanDerWaalsContact C-N 3.35Å; W76-G78 PolarHBondContact O-N 3.2Å; W76-L79 PolarHBondContact O-N 3.03Å; W76-L79 VanDerWaalsContact O-N 3.15Å; W76-V80 PolarHBondContact O-N 3.33Å; W76-C104 WeakPolarHBondContact CZ2-SG 3.41Å
77	C	80.6	Confident	83	Confident	77 Å²	77	48.9 Å²	48.9	52%	0.52	27%	0.268	S	S	.	.	H	α-helix	trans	-61.5	-40.4	-175.8	-56.5	0	0	0	0	113.2	L74 V80 G81	L74-C77 HydrophobicContact CB-CB 4.48Å; L74-C77 PolarHBondContact O-N 2.85Å; C77-V80 PolarHBondContact O-N 2.81Å; C77-G81 PolarHBondContact O-N 3.47Å
78	G	85.6	Confident	83.1	Confident	5 Å²	5	50.9 Å²	50.9	5%	0.052	28%	0.281	C	S	.	.	H	α-helix	trans	-64	-42.3	177	0	0	0	0	0	111.6	Y71 L74 W76 V80 G81 L82	Y71-G78 VanDerWaalsContact CD1-CA 3.44Å; Y71-G78 WeakPolarHBondContact CD1-O 3.22Å; L74-G78 WeakPolarHBondContact O-CA 3.29Å; L74-G78 PolarHBondContact O-N 3.4Å; W76-G78 VanDerWaalsContact C-N 3.35Å; W76-G78 PolarHBondContact O-N 3.2Å; G78-V80 VanDerWaalsContact C-N 3.31Å; G78-V80 PolarHBondContact O-N 2.96Å; G78-G81 PolarHBondContact O-N 3.15Å; G78-L82 PolarHBondContact O-N 2.91Å
79	L	89.7	Confident	83.4	Confident	1 Å²	1	44.2 Å²	44.2	1%	0.005	25%	0.254	C	S	.	.	H	α-helix	trans	-67.2	-32.1	-178.7	-167.5	57.6	0	0	0	112.3	L58 L61 P75 W76 L82 R83 L103 I110 A111 M114	L58-L79 HydrophobicContact CD2-CD1 3.77Å; L58-L79 HydrophobicContact CD2-CD2 4.25Å; L58-L79 HydrophobicContact CD2-CG 4.47Å; L61-L79 HydrophobicContact CD1-CD1 4.27Å; P75-L79 VanDerWaalsContact O-CB 3.26Å; P75-L79 WeakPolarHBondContact O-CB 3.12Å; W76-L79 PolarHBondContact O-N 3.03Å; W76-L79 VanDerWaalsContact O-N 3.15Å; L79-L82 PolarHBondContact O-N 3.36Å; L79-R83 VanDerWaalsContact O-CB 3.26Å; L79-R83 WeakPolarHBondContact O-CB 3.42Å; L79-R83 PolarHBondContact O-N 3.37Å; L79-L103 HydrophobicContact CB-CD1 4.49Å; L79-L103 HydrophobicContact CB-CD2 4.06Å; L79-L103 HydrophobicContact CD2-CD2 3.36Å; L79-L103 HydrophobicContact CG-CD1 4.43Å; L79-L103 HydrophobicContact CG-CD2 3.64Å; L79-I110 HydrophobicContact CD2-CG2 4.39Å; L79-A111 HydrophobicContact CD2-CB 3.81Å; L79-M114 HydrophobicContact CD1-CE 3.9Å; L79-M114 HydrophobicContact CD1-SD 3.61Å; L79-M114 HydrophobicContact CG-SD 4.17Å
80	V	92	Very high	84.4	Confident	24 Å²	24	43 Å²	43	15%	0.145	24%	0.24	C	C	.	.	H	α-helix	trans	-58.9	-50.3	171	178.9	0	0	0	0	110.4	W76 C77 G78 L82 R83 M84 L103	W76-V80 PolarHBondContact O-N 3.33Å; C77-V80 PolarHBondContact O-N 2.81Å; G78-V80 VanDerWaalsContact C-N 3.31Å; G78-V80 PolarHBondContact O-N 2.96Å; V80-L82 PolarHBondContact O-N 3.23Å; V80-R83 PolarHBondContact O-N 3.32Å; V80-M84 HydrophobicContact CG1-SD 4.09Å; V80-M84 WeakPolarHBondContact O-CG 3.42Å; V80-M84 PolarHBondContact O-N 3.15Å; V80-L103 VanDerWaalsContact CA-CD1 3.47Å; V80-L103 HydrophobicContact CB-CD1 3.99Å; V80-L103 HydrophobicContact CG2-CB 4.34Å; V80-L103 HydrophobicContact CG2-CD1 3.41Å; V80-L103 VanDerWaalsContact CG2-CD1 3.41Å; V80-L103 HydrophobicContact CG2-CG 4.48Å
81	G	89.9	Confident	84.7	Confident	28 Å²	28	39.9 Å²	39.9	29%	0.289	22%	0.22	S	C	.	.	H	α-helix	trans	-61.1	-44.3	179.5	0	0	0	0	0	112.8	C77 G78 R83 M84 K85	C77-G81 PolarHBondContact O-N 3.47Å; G78-G81 PolarHBondContact O-N 3.15Å; G81-R83 VanDerWaalsContact C-N 3.33Å; G81-R83 PolarHBondContact O-N 3.45Å; G81-M84 PolarHBondContact O-N 3.24Å; G81-K85 WeakPolarHBondContact O-CB 3.37Å; G81-K85 PolarHBondContact O-N 3.25Å
82	L	91.4	Very high	85.5	Confident	2 Å²	2	37.9 Å²	37.9	1%	0.01	21%	0.212	C	C	.	.	H	α-helix	trans	-63.8	-38.4	175.8	-70.8	174.9	0	0	0	112.3	M65 E67 Y71 G78 L79 V80 K85 M86 M114	M65-L82 HydrophobicContact CB-CD2 3.97Å; M65-L82 HydrophobicContact CG-CD2 4.2Å; E67-L82 HydrophobicContact CB-CD2 4.13Å; E67-L82 HydrophobicContact CG-CD2 4.05Å; Y71-L82 HydrophobicContact CD1-CD1 4.12Å; Y71-L82 HydrophobicContact CD1-CD2 4.13Å; Y71-L82 HydrophobicContact CD1-CG 3.67Å; Y71-L82 HydrophobicContact CE1-CD2 4.33Å; Y71-L82 HydrophobicContact CE1-CG 4.1Å; Y71-L82 HydrophobicContact CG-CD1 4.28Å; Y71-L82 HydrophobicContact CG-CD2 4.32Å; Y71-L82 HydrophobicContact CG-CG 4.15Å; G78-L82 PolarHBondContact O-N 2.91Å; L79-L82 PolarHBondContact O-N 3.36Å; V80-L82 PolarHBondContact O-N 3.23Å; L82-K85 PolarHBondContact O-N 3.42Å; L82-M86 WeakPolarHBondContact O-CB 3.26Å; L82-M86 PolarHBondContact O-N 3.46Å; L82-M114 HydrophobicContact CB-CE 3.9Å
83	R	93.2	Very high	86.4	Confident	1 Å²	1	41.5 Å²	41.5	0%	0.004	23%	0.229	C	C	.	.	H	α-helix	trans	-65.6	-48.4	179.1	-171.9	169.8	177.4	91	-9.8	111.1	W33 L79 V80 G81 K85 M86 R87 D99 Q113 M114	W33-R83 HydrophobicContact CH2-CG 4.15Å; W33-R83 HydrophobicContact CZ2-CG 3.96Å; W33-R83 VanDerWaalsContact CZ2-CZ 3.43Å; L79-R83 VanDerWaalsContact O-CB 3.26Å; L79-R83 WeakPolarHBondContact O-CB 3.42Å; L79-R83 PolarHBondContact O-N 3.37Å; V80-R83 PolarHBondContact O-N 3.32Å; G81-R83 VanDerWaalsContact C-N 3.33Å; G81-R83 PolarHBondContact O-N 3.45Å; R83-K85 VanDerWaalsContact C-N 3.31Å; R83-K85 PolarHBondContact O-N 3.37Å; R83-M86 PolarHBondContact O-N 2.78Å; R83-R87 VanDerWaalsContact O-CG 3.26Å; R83-R87 WeakPolarHBondContact O-CG 3.45Å; R83-R87 PolarHBondContact O-N 3.27Å; R83-D99 WeakPolarHBondContact CD-OD1 3.35Å; R83-D99 HydrophobicContact CG-CB 4.44Å; R83-D99 IonicContact CZ-OD1 3.83Å; R83-D99 IonicContact NE-OD1 2.68Å; R83-D99 PolarHBondContact NE-OD1 2.95Å; R83-D99 IonicContact NH2-OD1 2.75Å; R83-Q113 VanDerWaalsContact CZ-OE1 3.3Å; R83-M114 VanDerWaalsContact CA-CE 3.46Å; R83-M114 HydrophobicContact CB-CE 3.91Å; R83-M114 HydrophobicContact CB-SD 3.6Å; R83-M114 HydrophobicContact CG-SD 3.86Å
84	M	91.5	Very high	87.1	Confident	88 Å²	88	39.4 Å²	39.4	43%	0.433	22%	0.224	S	C	.	.	H	α-helix	trans	-58.6	-44.8	175.7	-68.6	177.3	69.7	0	0	111.1	V80 G81 R87 T88	V80-M84 HydrophobicContact CG1-SD 4.09Å; V80-M84 WeakPolarHBondContact O-CG 3.42Å; V80-M84 PolarHBondContact O-N 3.15Å; G81-M84 PolarHBondContact O-N 3.24Å; M84-R87 PolarHBondContact O-N 2.92Å; M84-T88 WeakPolarHBondContact O-CG2 3.26Å; M84-T88 PolarHBondContact O-N 2.78Å; M84-T88 PolarHBondContact O-OG1 3.34Å
85	K	89.7	Confident	87.7	Confident	34 Å²	34	38.5 Å²	38.5	15%	0.148	22%	0.22	C	C	.	.	H	α-helix	trans	-61.1	-47.7	176.9	-170.7	-177.7	-179.2	176.5	0	112	M65 E67 G81 L82 R83 R87 T88 S89	M65-K85 HydrophobicContact CB-CD 4.43Å; M65-K85 HydrophobicContact CE-CB 3.98Å; M65-K85 HydrophobicContact CE-CD 3.73Å; M65-K85 HydrophobicContact CE-CG 3.53Å; M65-K85 PolarHBondContact O-NZ 3.48Å; E67-K85 HydrophobicContact CG-CD 4.15Å; E67-K85 IonicContact OE1-NZ 3.71Å; E67-K85 PolarHBondContact OE1-NZ 3.34Å; G81-K85 WeakPolarHBondContact O-CB 3.37Å; G81-K85 PolarHBondContact O-N 3.25Å; L82-K85 PolarHBondContact O-N 3.42Å; R83-K85 VanDerWaalsContact C-N 3.31Å; R83-K85 PolarHBondContact O-N 3.37Å; K85-R87 VanDerWaalsContact C-N 3.25Å; K85-R87 PolarHBondContact O-N 2.89Å; K85-T88 PolarHBondContact O-N 3.01Å; K85-T88 PolarHBondContact O-OG1 3.27Å; K85-S89 VanDerWaalsContact O-CB 3.25Å; K85-S89 WeakPolarHBondContact O-CB 3.26Å; K85-S89 PolarHBondContact O-N 3.3Å; K85-S89 PolarHBondContact O-OG 3.02Å
86	M	91.3	Very high	88.5	Confident	0 Å²	0	37.3 Å²	37.3	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-58.4	-42	178.3	179.7	174.4	-84.1	0	0	111.2	W33 L61 M65 L82 R83 S89 Y90 I92 M114 E117 A118	W33-M86 HydrophobicContact CH2-CG 4.34Å; W33-M86 HydrophobicContact CH2-SD 3.91Å; W33-M86 HydrophobicContact CZ3-CG 4.44Å; W33-M86 HydrophobicContact CZ3-SD 3.68Å; L61-M86 HydrophobicContact CD2-CE 4Å; M65-M86 HydrophobicContact CE-CB 4.08Å; M65-M86 HydrophobicContact SD-CB 4.21Å; M65-M86 HydrophobicContact SD-CE 4.07Å; L82-M86 WeakPolarHBondContact O-CB 3.26Å; L82-M86 PolarHBondContact O-N 3.46Å; R83-M86 PolarHBondContact O-N 2.78Å; M86-S89 PolarHBondContact O-N 3.2Å; M86-Y90 HydrophobicContact CG-CD2 3.85Å; M86-Y90 HydrophobicContact CG-CE2 4.34Å; M86-Y90 WeakPolarHBondContact O-CB 3.43Å; M86-Y90 VanDerWaalsContact O-CD2 3.25Å; M86-Y90 WeakPolarHBondContact O-CD2 3.27Å; M86-Y90 PolarHBondContact O-N 3.33Å; M86-I92 HydrophobicContact CG-CD1 4.33Å; M86-M114 HydrophobicContact CE-CB 4.49Å; M86-M114 HydrophobicContact SD-CB 4.11Å; M86-M114 HydrophobicContact SD-CE 4.33Å; M86-M114 HydrophobicContact SD-CG 4.23Å; M86-E117 HydrophobicContact SD-CB 4.33Å; M86-E117 HydrophobicContact SD-CG 4.21Å; M86-A118 HydrophobicContact CE-CB 3.89Å
87	R	91.5	Very high	89.3	Confident	26 Å²	26	36.1 Å²	36.1	10%	0.098	22%	0.224	C	C	.	.	H	α-helix	trans	-64.9	-43.2	179.1	-70.7	-177.6	58.2	-143	-32.3	113	W33 R83 M84 K85 G91 I92 E93 G94 D95 D99	W33-R87 HydrophobicContact CH2-CG 4.05Å; W33-R87 HydrophobicContact CZ2-CG 3.48Å; W33-R87 VanDerWaalsContact CZ2-CG 3.48Å; R83-R87 VanDerWaalsContact O-CG 3.26Å; R83-R87 WeakPolarHBondContact O-CG 3.45Å; R83-R87 PolarHBondContact O-N 3.27Å; M84-R87 PolarHBondContact O-N 2.92Å; K85-R87 VanDerWaalsContact C-N 3.25Å; K85-R87 PolarHBondContact O-N 2.89Å; R87-G91 CarbonylContact O-C 3.6Å; R87-G91 WeakPolarHBondContact O-CA 3.43Å; R87-G91 PolarHBondContact O-N 3.5Å; R87-I92 HydrophobicContact CB-CB 4.14Å; R87-I92 WeakPolarHBondContact CB-O 3.34Å; R87-I92 HydrophobicContact CG-CB 3.92Å; R87-I92 HydrophobicContact CG-CG2 4.18Å; R87-I92 PolarHBondContact NE-O 3.42Å; R87-I92 VanDerWaalsContact NE-O 3.09Å; R87-I92 PolarHBondContact NH2-O 2.87Å; R87-I92 PolarHBondContact O-N 3.29Å; R87-E93 PolarHBondContact NE-O 3.42Å; R87-E93 VanDerWaalsContact NE-O 3.09Å; R87-E93 PolarHBondContact NH2-O 3Å; R87-G94 PolarHBondContact NH2-O 3.21Å; R87-D95 PolarHBondContact NH1-O 2.73Å; R87-D99 VanDerWaalsContact CD-OD2 3.26Å; R87-D99 WeakPolarHBondContact CD-OD2 3.39Å; R87-D99 IonicContact CZ-OD2 3.17Å; R87-D99 IonicContact NE-OD2 2.76Å; R87-D99 IonicContact NH1-OD1 2.66Å; R87-D99 IonicContact NH1-OD2 2.78Å; R87-D99 PolarHBondContact NH1-OD2 3.31Å
88	T	87.2	Confident	89.8	Confident	59 Å²	59	38.1 Å²	38.1	36%	0.362	22%	0.223	S	C	.	.	H	α-helix	trans	-74.1	-36.1	178.9	59.6	0	0	0	0	112.2	T9 M84 K85	T9-T88 HydrophobicContact CG2-CG2 4.17Å; M84-T88 WeakPolarHBondContact O-CG2 3.26Å; M84-T88 PolarHBondContact O-N 2.78Å; M84-T88 PolarHBondContact O-OG1 3.34Å; K85-T88 PolarHBondContact O-N 3.01Å; K85-T88 PolarHBondContact O-OG1 3.27Å
89	S	86.3	Confident	90.2	Very high	14 Å²	14	38 Å²	38	10%	0.098	22%	0.222	C	C	.	.	H	α-helix	trans	-70.5	-32.5	177.6	-61.6	0	0	0	0	113.9	K85 M86	K85-S89 VanDerWaalsContact O-CB 3.25Å; K85-S89 WeakPolarHBondContact O-CB 3.26Å; K85-S89 PolarHBondContact O-N 3.3Å; K85-S89 PolarHBondContact O-OG 3.02Å; M86-S89 PolarHBondContact O-N 3.2Å
90	Y	88.3	Confident	90.3	Very high	64 Å²	64	40 Å²	40	25%	0.251	24%	0.236	S	C	.	.	H	α-helix	trans	-119.9	15.3	-173.3	-56.1	-71.5	0	0	0	114.1	R31 M65 M86 I121 V123	R31-Y90 PolarHBondContact NE-O 2.75Å; R31-Y90 PolarHBondContact NH2-O 2.98Å; M65-Y90 HydrophobicContact CE-CE2 4.13Å; M65-Y90 HydrophobicContact SD-CE2 3.81Å; M86-Y90 HydrophobicContact CG-CD2 3.85Å; M86-Y90 HydrophobicContact CG-CE2 4.34Å; M86-Y90 WeakPolarHBondContact O-CB 3.43Å; M86-Y90 VanDerWaalsContact O-CD2 3.25Å; M86-Y90 WeakPolarHBondContact O-CD2 3.27Å; M86-Y90 PolarHBondContact O-N 3.33Å; Y90-I121 HydrophobicContact CD1-CD1 4.12Å; Y90-I121 HydrophobicContact CD1-CG2 3.62Å; Y90-I121 HydrophobicContact CD2-CD1 3.72Å; Y90-I121 HydrophobicContact CE1-CG2 3.55Å; Y90-I121 HydrophobicContact CE2-CD1 4.27Å; Y90-I121 HydrophobicContact CG-CD1 3.63Å; Y90-I121 HydrophobicContact CG-CG2 4.27Å; Y90-V123 HydrophobicContact CE1-CG1 4.32Å; Y90-V123 VanDerWaalsContact OH-CG1 3.27Å; Y90-V123 WeakPolarHBondContact OH-CG1 3.37Å
91	G	86.3	Confident	90.3	Very high	9 Å²	9	42.3 Å²	42.3	9%	0.093	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	71.3	34.9	170.2	0	0	0	0	0	115.2	P29 H30 R31 R87	P29-G91 VanDerWaalsContact CA-O 3.26Å; P29-G91 WeakPolarHBondContact CA-O 3.32Å; P29-G91 WeakPolarHBondContact CB-O 3.29Å; H30-G91 PolarHBondContact N-O 3.45Å; R31-G91 VanDerWaalsContact CG-O 3.29Å; R31-G91 WeakPolarHBondContact CG-O 3.23Å; R31-G91 PolarHBondContact N-O 2.66Å; R87-G91 CarbonylContact O-C 3.6Å; R87-G91 WeakPolarHBondContact O-CA 3.43Å; R87-G91 PolarHBondContact O-N 3.5Å
92	I	91.4	Very high	90.3	Very high	1 Å²	1	43 Å²	43	1%	0.005	25%	0.247	C	C	.	.	B	Isolated β-bridge	trans	-95.8	124.5	-177.5	-50.8	169.3	0	0	0	111.5	R31 W33 M86 R87 E117	R31-I92 WeakPolarHBondContact O-CA 3.48Å; W33-I92 HydrophobicContact CD2-CD1 4.23Å; W33-I92 HydrophobicContact CD2-CG2 3.9Å; W33-I92 HydrophobicContact CE3-CD1 3.91Å; W33-I92 HydrophobicContact CG-CG2 3.93Å; W33-I92 HydrophobicContact CH2-CD1 4.1Å; W33-I92 HydrophobicContact CZ2-CD1 4.42Å; W33-I92 HydrophobicContact CZ2-CG2 4.28Å; W33-I92 HydrophobicContact CZ3-CD1 3.84Å; M86-I92 HydrophobicContact CG-CD1 4.33Å; R87-I92 HydrophobicContact CB-CB 4.14Å; R87-I92 WeakPolarHBondContact CB-O 3.34Å; R87-I92 HydrophobicContact CG-CB 3.92Å; R87-I92 HydrophobicContact CG-CG2 4.18Å; R87-I92 PolarHBondContact NE-O 3.42Å; R87-I92 VanDerWaalsContact NE-O 3.09Å; R87-I92 PolarHBondContact NH2-O 2.87Å; R87-I92 PolarHBondContact O-N 3.29Å; I92-E117 HydrophobicContact CD1-CG 3.94Å
93	E	90	Very high	90.3	Very high	79 Å²	79	43 Å²	43	37%	0.369	25%	0.247	S	C	.	.			trans	-67.4	161.4	179.5	-70.7	-173.6	-178.4	0	0	114.8	P29 R31 Q32 R87	P29-E93 HydrophobicContact CB-CG 4.41Å; R31-E93 PolarHBondContact O-N 3.49Å; Q32-E93 PolarHBondContact NE2-OE2 3.47Å; R87-E93 PolarHBondContact NE-O 3.42Å; R87-E93 VanDerWaalsContact NE-O 3.09Å; R87-E93 PolarHBondContact NH2-O 3Å
94	G	89.2	Confident	90.1	Very high	53 Å²	53	46 Å²	46	55%	0.546	27%	0.268	S	S	.	.			trans	135.4	-165.9	178.1	0	0	0	0	0	113.7	R87	R87-G94 PolarHBondContact NH2-O 3.21Å
95	D	89.5	Confident	89.9	Confident	84 Å²	84	50.3 Å²	50.3	45%	0.449	29%	0.285	S	S	.	.			trans	-134.9	146.4	-176.6	163.1	48.8	0	0	0	111.6	R87 C97 K98 D99	R87-D95 PolarHBondContact NH1-O 2.73Å; D95-C97 PolarHBondContact OD1-N 2.92Å; D95-C97 VanDerWaalsContact OD2-CB 3.26Å; D95-C97 WeakPolarHBondContact OD2-CB 3.28Å; D95-C97 PolarHBondContact OD2-N 2.68Å; D95-K98 HydrophobicContact CB-CB 4.14Å; D95-K98 WeakPolarHBondContact O-CB 3.4Å; D95-K98 PolarHBondContact O-N 2.88Å; D95-K98 PolarHBondContact OD2-N 3.31Å; D95-D99 PolarHBondContact O-N 2.73Å
96	G	88.8	Confident	89.8	Confident	21 Å²	21	50.8 Å²	50.8	22%	0.216	29%	0.292	C	S	.	.	H	α-helix	trans	-67.1	-34.6	-179.5	0	0	0	0	0	113.1	D99 C100	G96-D99 PolarHBondContact O-N 3.47Å; G96-C100 WeakPolarHBondContact O-CB 3.29Å; G96-C100 PolarHBondContact O-N 3.42Å
97	C	91.8	Very high	89.7	Confident	89 Å²	89	52.7 Å²	52.7	60%	0.601	30%	0.302	S	S	*	.	H	α-helix	trans	-67.6	-42.9	173.9	-65.9	0	0	0	0	110.7	D95 D99 C100 C101	D95-C97 PolarHBondContact OD1-N 2.92Å; D95-C97 VanDerWaalsContact OD2-CB 3.26Å; D95-C97 WeakPolarHBondContact OD2-CB 3.28Å; D95-C97 PolarHBondContact OD2-N 2.68Å; C97-D99 VanDerWaalsContact C-N 3.33Å; C97-D99 PolarHBondContact O-N 3.48Å; C97-C100 WeakPolarHBondContact O-CB 3.47Å; C97-C100 PolarHBondContact O-N 2.86Å; C97-C101 PolarHBondContact O-N 2.98Å; C97-C101 PolarHBondContact O-SG 3.23Å; C97-C101 VanDerWaalsContact O-SG 3.36Å
98	K	91.6	Very high	89.4	Confident	118 Å²	118	52.6 Å²	52.6	51%	0.513	31%	0.309	S	S	.	.	H	α-helix	trans	-58.1	-43.7	172.6	-172.6	176.3	-178	178.1	0	112.3	D95 C100 C101 Q102	D95-K98 HydrophobicContact CB-CB 4.14Å; D95-K98 WeakPolarHBondContact O-CB 3.4Å; D95-K98 PolarHBondContact O-N 2.88Å; D95-K98 PolarHBondContact OD2-N 3.31Å; K98-C100 VanDerWaalsContact C-N 3.35Å; K98-C100 PolarHBondContact O-N 2.7Å; K98-C101 PolarHBondContact O-N 3.34Å; K98-Q102 VanDerWaalsContact CE-NE2 3.33Å; K98-Q102 HydrophobicContact CG-CG 4.35Å; K98-Q102 WeakPolarHBondContact O-CB 3.35Å; K98-Q102 WeakPolarHBondContact O-CG 3.45Å; K98-Q102 PolarHBondContact O-N 2.87Å
99	D	93	Very high	89.6	Confident	3 Å²	3	51.1 Å²	51.1	2%	0.016	30%	0.301	C	S	.	.	H	α-helix	trans	-60.2	-44.6	176.2	-74.3	-25.1	0	0	0	111.6	R83 R87 D95 G96 C97 Q102 L103	R83-D99 WeakPolarHBondContact CD-OD1 3.35Å; R83-D99 HydrophobicContact CG-CB 4.44Å; R83-D99 IonicContact CZ-OD1 3.83Å; R83-D99 IonicContact NE-OD1 2.68Å; R83-D99 PolarHBondContact NE-OD1 2.95Å; R83-D99 IonicContact NH2-OD1 2.75Å; R87-D99 VanDerWaalsContact CD-OD2 3.26Å; R87-D99 WeakPolarHBondContact CD-OD2 3.39Å; R87-D99 IonicContact CZ-OD2 3.17Å; R87-D99 IonicContact NE-OD2 2.76Å; R87-D99 IonicContact NH1-OD1 2.66Å; R87-D99 IonicContact NH1-OD2 2.78Å; R87-D99 PolarHBondContact NH1-OD2 3.31Å; D95-D99 PolarHBondContact O-N 2.73Å; G96-D99 PolarHBondContact O-N 3.47Å; C97-D99 VanDerWaalsContact C-N 3.33Å; C97-D99 PolarHBondContact O-N 3.48Å; D99-Q102 PolarHBondContact O-N 3.34Å; D99-L103 VanDerWaalsContact O-CB 3.31Å; D99-L103 WeakPolarHBondContact O-CB 3.26Å; D99-L103 WeakPolarHBondContact O-CD1 3.46Å; D99-L103 WeakPolarHBondContact O-CG 3.34Å; D99-L103 PolarHBondContact O-N 2.97Å
100	C	91.8	Very high	89.8	Confident	44 Å²	44	50.4 Å²	50.4	30%	0.297	30%	0.296	S	S	.	.	H	α-helix	trans	-59.2	-52.6	175.8	-176.4	0	0	0	0	111.8	G96 C97 K98 Q102 L103 C104	G96-C100 WeakPolarHBondContact O-CB 3.29Å; G96-C100 PolarHBondContact O-N 3.42Å; C97-C100 WeakPolarHBondContact O-CB 3.47Å; C97-C100 PolarHBondContact O-N 2.86Å; K98-C100 VanDerWaalsContact C-N 3.35Å; K98-C100 PolarHBondContact O-N 2.7Å; C100-Q102 PolarHBondContact O-N 3.16Å; C100-L103 PolarHBondContact O-N 3.35Å; C100-C104 PolarHBondContact O-N 3.49Å; C100-C104 PolarHBondContact O-SG 2.97Å
101	C	92	Very high	89.9	Confident	71 Å²	71	47.4 Å²	47.4	48%	0.48	28%	0.284	S	S	.	.	H	α-helix	trans	-60.2	-45	179.6	-66.3	0	0	0	0	112	C97 K98 L103 C104 F105	C97-C101 PolarHBondContact O-N 2.98Å; C97-C101 PolarHBondContact O-SG 3.23Å; C97-C101 VanDerWaalsContact O-SG 3.36Å; K98-C101 PolarHBondContact O-N 3.34Å; C101-L103 VanDerWaalsContact C-N 3.28Å; C101-L103 PolarHBondContact O-N 3.47Å; C101-C104 WeakPolarHBondContact O-CB 3.47Å; C101-C104 PolarHBondContact O-N 3.34Å; C101-F105 WeakPolarHBondContact O-CD2 3.29Å
102	Q	91.6	Very high	90.1	Very high	44 Å²	44	47 Å²	47	21%	0.206	28%	0.28	C	S	.	.	H	α-helix	trans	-62.9	-37.2	178.2	-72.1	177.6	-22.7	0	0	111.9	I37 K98 D99 C100 F105 C106 I110	I37-Q102 HydrophobicContact CD1-CB 4.47Å; I37-Q102 HydrophobicContact CD1-CG 4.04Å; K98-Q102 VanDerWaalsContact CE-NE2 3.33Å; K98-Q102 HydrophobicContact CG-CG 4.35Å; K98-Q102 WeakPolarHBondContact O-CB 3.35Å; K98-Q102 WeakPolarHBondContact O-CG 3.45Å; K98-Q102 PolarHBondContact O-N 2.87Å; D99-Q102 PolarHBondContact O-N 3.34Å; C100-Q102 PolarHBondContact O-N 3.16Å; Q102-F105 PolarHBondContact O-N 3.43Å; Q102-C106 WeakPolarHBondContact O-CA 3.23Å; Q102-C106 WeakPolarHBondContact O-CB 3.45Å; Q102-C106 PolarHBondContact O-N 3.4Å; Q102-I110 HydrophobicContact CB-CD1 3.95Å; Q102-I110 HydrophobicContact CB-CG1 4.38Å
103	L	90.7	Very high	90.1	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-68.9	-29.3	175.8	-83.2	164.8	0	0	0	113.6	L79 V80 D99 C100 C101 F105 N107 I110	L79-L103 HydrophobicContact CB-CD1 4.49Å; L79-L103 HydrophobicContact CB-CD2 4.06Å; L79-L103 HydrophobicContact CD2-CD2 3.36Å; L79-L103 HydrophobicContact CG-CD1 4.43Å; L79-L103 HydrophobicContact CG-CD2 3.64Å; V80-L103 VanDerWaalsContact CA-CD1 3.47Å; V80-L103 HydrophobicContact CB-CD1 3.99Å; V80-L103 HydrophobicContact CG2-CB 4.34Å; V80-L103 HydrophobicContact CG2-CD1 3.41Å; V80-L103 VanDerWaalsContact CG2-CD1 3.41Å; V80-L103 HydrophobicContact CG2-CG 4.48Å; D99-L103 VanDerWaalsContact O-CB 3.31Å; D99-L103 WeakPolarHBondContact O-CB 3.26Å; D99-L103 WeakPolarHBondContact O-CD1 3.46Å; D99-L103 WeakPolarHBondContact O-CG 3.34Å; D99-L103 PolarHBondContact O-N 2.97Å; C100-L103 PolarHBondContact O-N 3.35Å; C101-L103 VanDerWaalsContact C-N 3.28Å; C101-L103 PolarHBondContact O-N 3.47Å; L103-F105 VanDerWaalsContact C-N 3.33Å; L103-N107 WeakPolarHBondContact O-CB 3.49Å; L103-N107 PolarHBondContact O-N 2.96Å; L103-I110 HydrophobicContact CD1-CG2 4.42Å; L103-I110 HydrophobicContact CD2-CB 3.7Å; L103-I110 HydrophobicContact CD2-CG1 4.23Å; L103-I110 HydrophobicContact CD2-CG2 3.37Å; L103-I110 HydrophobicContact CG-CB 4.3Å; L103-I110 HydrophobicContact CG-CG1 4.38Å; L103-I110 HydrophobicContact CG-CG2 3.81Å
104	C	88.3	Confident	90.2	Very high	66 Å²	66	43.4 Å²	43.4	45%	0.446	26%	0.263	S	S	.	.	H	α-helix	trans	-61.9	-41	173.8	-63.3	0	0	0	0	112.4	W76 C100 C101	W76-C104 WeakPolarHBondContact CZ2-SG 3.41Å; C100-C104 PolarHBondContact O-N 3.49Å; C100-C104 PolarHBondContact O-SG 2.97Å; C101-C104 WeakPolarHBondContact O-CB 3.47Å; C101-C104 PolarHBondContact O-N 3.34Å
105	F	86.6	Confident	90.2	Very high	178 Å²	178	41.1 Å²	41.1	78%	0.781	24%	0.238	S	C	*	.	H	α-helix	trans	-101	-21.7	-171.2	-58.5	-67.9	0	0	0	113.7	C101 Q102 L103	C101-F105 WeakPolarHBondContact O-CD2 3.29Å; Q102-F105 PolarHBondContact O-N 3.43Å; L103-F105 VanDerWaalsContact C-N 3.33Å
106	C	89.2	Confident	90.3	Very high	44 Å²	44	38.8 Å²	38.8	30%	0.297	22%	0.223	S	C	.	.	H	α-helix	trans	-139	39.7	-169.1	-75	0	0	0	0	111.9	I37 Q102 G108 C109 I110	I37-C106 HydrophobicContact CG2-CB 4.02Å; Q102-C106 WeakPolarHBondContact O-CA 3.23Å; Q102-C106 WeakPolarHBondContact O-CB 3.45Å; Q102-C106 PolarHBondContact O-N 3.4Å; C106-G108 PolarHBondContact O-N 2.92Å; C106-C109 HydrophobicContact CB-CB 4.11Å; C106-C109 PolarHBondContact O-N 3.2Å; C106-C109 VanDerWaalsContact O-N 3.16Å; C106-I110 HydrophobicContact CB-CG1 4.35Å; C106-I110 WeakPolarHBondContact O-CB 3.26Å; C106-I110 VanDerWaalsContact O-CG1 3.23Å; C106-I110 WeakPolarHBondContact O-CG1 3.5Å; C106-I110 PolarHBondContact O-N 3.27Å
107	N	87.9	Confident	90.4	Very high	39 Å²	39	37.9 Å²	37.9	21%	0.209	21%	0.213	C	C	.	.	H	α-helix	trans	-51.1	-52.6	-174.9	-177.2	-96.4	0	0	0	113.7	Y54 P75 L103 C109 I110 A111	Y54-N107 WeakPolarHBondContact CE2-OD1 3.27Å; Y54-N107 PolarHBondContact OH-OD1 2.93Å; P75-N107 PolarHBondContact O-ND2 3.27Å; P75-N107 VanDerWaalsContact O-ND2 3.15Å; L103-N107 WeakPolarHBondContact O-CB 3.49Å; L103-N107 PolarHBondContact O-N 2.96Å; N107-C109 PolarHBondContact O-N 3.39Å; N107-I110 PolarHBondContact O-N 3.36Å; N107-A111 PolarHBondContact O-N 2.97Å
108	G	86.6	Confident	90.4	Very high	25 Å²	25	33.6 Å²	33.6	26%	0.258	19%	0.185	S	C	.	.	H	α-helix	trans	-63.9	-41	178	0	0	0	0	0	113.6	C106 I110 A111 C112	C106-G108 PolarHBondContact O-N 2.92Å; G108-I110 VanDerWaalsContact C-N 3.34Å; G108-I110 PolarHBondContact O-N 3.26Å; G108-A111 PolarHBondContact O-N 2.96Å; G108-C112 PolarHBondContact O-N 3.45Å
109	C	90	Very high	90.3	Very high	27 Å²	27	28.8 Å²	28.8	18%	0.182	16%	0.164	C	C	.	.	H	α-helix	trans	-62.9	-42.2	176.8	-61.5	0	0	0	0	111.7	I37 C106 N107 C112 Q113	I37-C109 HydrophobicContact CG2-CB 3.82Å; I37-C109 WeakPolarHBondContact O-CB 3.23Å; C106-C109 HydrophobicContact CB-CB 4.11Å; C106-C109 PolarHBondContact O-N 3.2Å; C106-C109 VanDerWaalsContact O-N 3.16Å; N107-C109 PolarHBondContact O-N 3.39Å; C109-C112 WeakPolarHBondContact O-CB 3.48Å; C109-C112 PolarHBondContact O-N 3.24Å; C109-Q113 PolarHBondContact O-N 3.31Å
110	I	92.1	Very high	90.2	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-65.7	-43.2	177.5	-67.7	-71.6	0	0	0	111.1	I37 L79 Q102 L103 C106 N107 G108 C112 Q113 M114	I37-I110 HydrophobicContact CB-CD1 4.26Å; I37-I110 HydrophobicContact CD1-CD1 4Å; I37-I110 HydrophobicContact CG1-CD1 3.73Å; I37-I110 HydrophobicContact CG2-CD1 3.62Å; I37-I110 HydrophobicContact CG2-CG1 4Å; L79-I110 HydrophobicContact CD2-CG2 4.39Å; Q102-I110 HydrophobicContact CB-CD1 3.95Å; Q102-I110 HydrophobicContact CB-CG1 4.38Å; L103-I110 HydrophobicContact CD1-CG2 4.42Å; L103-I110 HydrophobicContact CD2-CB 3.7Å; L103-I110 HydrophobicContact CD2-CG1 4.23Å; L103-I110 HydrophobicContact CD2-CG2 3.37Å; L103-I110 HydrophobicContact CG-CB 4.3Å; L103-I110 HydrophobicContact CG-CG1 4.38Å; L103-I110 HydrophobicContact CG-CG2 3.81Å; C106-I110 HydrophobicContact CB-CG1 4.35Å; C106-I110 WeakPolarHBondContact O-CB 3.26Å; C106-I110 VanDerWaalsContact O-CG1 3.23Å; C106-I110 WeakPolarHBondContact O-CG1 3.5Å; C106-I110 PolarHBondContact O-N 3.27Å; N107-I110 PolarHBondContact O-N 3.36Å; G108-I110 VanDerWaalsContact C-N 3.34Å; G108-I110 PolarHBondContact O-N 3.26Å; I110-C112 VanDerWaalsContact C-N 3.29Å; I110-C112 PolarHBondContact O-N 3.09Å; I110-Q113 WeakPolarHBondContact O-CB 3.42Å; I110-Q113 PolarHBondContact O-N 3.4Å; I110-M114 HydrophobicContact CG2-CG 4.46Å; I110-M114 HydrophobicContact CG2-SD 4.03Å; I110-M114 WeakPolarHBondContact O-CG 3.5Å; I110-M114 PolarHBondContact O-N 3.32Å
111	A	90	Very high	90.1	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-57.7	-44.8	175	0	0	0	0	0	111	Y54 L57 L58 L79 N107 G108 M114 H115	Y54-A111 HydrophobicContact CD2-CB 4.33Å; Y54-A111 HydrophobicContact CE2-CB 3.62Å; L57-A111 HydrophobicContact CD1-CB 4.42Å; L57-A111 HydrophobicContact CD2-CB 3.79Å; L58-A111 HydrophobicContact CD2-CB 4.41Å; L79-A111 HydrophobicContact CD2-CB 3.81Å; N107-A111 PolarHBondContact O-N 2.97Å; G108-A111 PolarHBondContact O-N 2.96Å; A111-M114 PolarHBondContact O-N 3.4Å; A111-H115 WeakPolarHBondContact O-CB 3.37Å; A111-H115 PolarHBondContact O-N 2.75Å
112	C	89.3	Confident	90	Very high	0 Å²	0	32 Å²	32	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-62.4	-45.1	173.4	-84	0	0	0	0	114	C40 W46 A50 G108 C109 I110 M114 H115 Y116	C40-C112 HydrophobicContact CB-CB 3.81Å; W46-C112 PolarHBondContact O-SG 3.45Å; A50-C112 VanDerWaalsContact CA-SG 3.58Å; A50-C112 HydrophobicContact CB-CB 4.48Å; A50-C112 WeakPolarHBondContact CB-SG 3.21Å; G108-C112 PolarHBondContact O-N 3.45Å; C109-C112 WeakPolarHBondContact O-CB 3.48Å; C109-C112 PolarHBondContact O-N 3.24Å; I110-C112 VanDerWaalsContact C-N 3.29Å; I110-C112 PolarHBondContact O-N 3.09Å; C112-M114 PolarHBondContact O-N 3.42Å; C112-H115 PolarHBondContact O-N 2.99Å; C112-Y116 WeakPolarHBondContact O-CB 3.08Å; C112-Y116 PolarHBondContact O-N 3.33Å
113	Q	92.3	Very high	89.8	Confident	6 Å²	6	32.5 Å²	32.5	3%	0.028	19%	0.19	C	C	.	.	H	α-helix	trans	-56	-45.2	177	-173.1	-168.7	33.8	0	0	110.3	W33 G35 R83 C109 I110 E117	W33-Q113 HydrophobicContact CD2-CG 4.43Å; W33-Q113 HydrophobicContact CE3-CG 4.2Å; G35-Q113 WeakPolarHBondContact O-CG 3.5Å; G35-Q113 PolarHBondContact O-NE2 2.8Å; R83-Q113 VanDerWaalsContact CZ-OE1 3.3Å; C109-Q113 PolarHBondContact O-N 3.31Å; I110-Q113 WeakPolarHBondContact O-CB 3.42Å; I110-Q113 PolarHBondContact O-N 3.4Å; Q113-E117 VanDerWaalsContact O-CB 3.27Å; Q113-E117 WeakPolarHBondContact O-CB 3.36Å; Q113-E117 PolarHBondContact O-N 3.4Å
114	M	92.8	Very high	89.7	Confident	0 Å²	0	33.3 Å²	33.3	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-67.7	-40	178.8	-70	176.4	60.5	0	0	112.8	W33 L61 L79 L82 R83 M86 I110 A111 C112 E117 A118	W33-M114 HydrophobicContact CH2-CG 3.9Å; W33-M114 HydrophobicContact CZ3-CG 4.04Å; L61-M114 HydrophobicContact CD1-CB 3.92Å; L61-M114 HydrophobicContact CD1-CE 4.38Å; L61-M114 HydrophobicContact CD2-CB 4.12Å; L79-M114 HydrophobicContact CD1-CE 3.9Å; L79-M114 HydrophobicContact CD1-SD 3.61Å; L79-M114 HydrophobicContact CG-SD 4.17Å; L82-M114 HydrophobicContact CB-CE 3.9Å; R83-M114 VanDerWaalsContact CA-CE 3.46Å; R83-M114 HydrophobicContact CB-CE 3.91Å; R83-M114 HydrophobicContact CB-SD 3.6Å; R83-M114 HydrophobicContact CG-SD 3.86Å; M86-M114 HydrophobicContact CE-CB 4.49Å; M86-M114 HydrophobicContact SD-CB 4.11Å; M86-M114 HydrophobicContact SD-CE 4.33Å; M86-M114 HydrophobicContact SD-CG 4.23Å; I110-M114 HydrophobicContact CG2-CG 4.46Å; I110-M114 HydrophobicContact CG2-SD 4.03Å; I110-M114 WeakPolarHBondContact O-CG 3.5Å; I110-M114 PolarHBondContact O-N 3.32Å; A111-M114 PolarHBondContact O-N 3.4Å; C112-M114 PolarHBondContact O-N 3.42Å; M114-E117 PolarHBondContact O-N 2.93Å; M114-A118 WeakPolarHBondContact O-CB 3.31Å; M114-A118 PolarHBondContact O-N 3.38Å
115	H	89.4	Confident	89.4	Confident	4 Å²	4	36.4 Å²	36.4	2%	0.019	20%	0.202	C	C	.	.	H	α-helix	trans	-68	-42.2	178.4	-173.7	-83.3	0	0	0	111.6	W46 F49 L57 Q60 L61 A111 C112 E117 A118 Q119	W46-H115 AromaticContact CH2-ND1 3.41Å; W46-H115 WeakPolarHBondContact CH2-ND1 3.41Å; W46-H115 HydrophobicContact CZ3-CB 4.12Å; W46-H115 AromaticContact CZ3-ND1 3.16Å; W46-H115 WeakPolarHBondContact CZ3-ND1 3.4Å; F49-H115 AromaticContact CE1-CE1 3.67Å; F49-H115 AromaticContact CE1-NE2 3.66Å; L57-H115 HydrophobicContact CD1-CB 4.01Å; L57-H115 HydrophobicContact CD2-CB 3.98Å; L57-H115 HydrophobicContact CG-CB 3.82Å; Q60-H115 PolarHBondContact OE1-NE2 3.22Å; L61-H115 HydrophobicContact CD2-CB 4.36Å; L61-H115 HydrophobicContact CG-CB 4.46Å; A111-H115 WeakPolarHBondContact O-CB 3.37Å; A111-H115 PolarHBondContact O-N 2.75Å; C112-H115 PolarHBondContact O-N 2.99Å; H115-E117 PolarHBondContact O-N 3.42Å; H115-A118 WeakPolarHBondContact O-CB 3.48Å; H115-A118 PolarHBondContact O-N 2.94Å; H115-Q119 PolarHBondContact CE1-NE2 3.36Å; H115-Q119 PolarHBondContact O-N 2.98Å
116	Y	89.6	Confident	88.7	Confident	36 Å²	36	35.2 Å²	35.2	14%	0.141	20%	0.197	C	C	.	.	H	α-helix	trans	-59	-47.4	171.6	176.2	-103.5	0	0	0	111.4	T34 Y39 W46 C112 A118 Q119 Q120	T34-Y116 HydrophobicContact CG2-CE1 4.05Å; Y39-Y116 HydrophobicContact CD1-CD2 4.35Å; Y39-Y116 HydrophobicContact CD1-CG 4.23Å; Y39-Y116 HydrophobicContact CE1-CD1 4.46Å; Y39-Y116 AromaticContact CE1-CD2 3.62Å; Y39-Y116 HydrophobicContact CE1-CD2 3.62Å; Y39-Y116 AromaticContact CE1-CE2 3.82Å; Y39-Y116 HydrophobicContact CE1-CE2 3.82Å; Y39-Y116 AromaticContact CE1-CG 3.95Å; Y39-Y116 HydrophobicContact CE1-CG 3.95Å; Y39-Y116 HydrophobicContact CE2-CE1 4.48Å; Y39-Y116 HydrophobicContact CE2-CE2 4.4Å; Y39-Y116 AromaticContact CZ-CD2 3.91Å; Y39-Y116 AromaticContact CZ-CE2 3.59Å; Y39-Y116 AromaticContact CZ-CZ 3.84Å; Y39-Y116 WeakPolarHBondContact OH-CE2 3.43Å; W46-Y116 HydrophobicContact CH2-CD2 4.13Å; W46-Y116 AromaticContact CZ2-CD2 3.73Å; W46-Y116 HydrophobicContact CZ2-CD2 3.73Å; C112-Y116 WeakPolarHBondContact O-CB 3.08Å; C112-Y116 PolarHBondContact O-N 3.33Å; Y116-A118 VanDerWaalsContact C-N 3.32Å; Y116-A118 PolarHBondContact O-N 2.95Å; Y116-Q119 WeakPolarHBondContact O-CB 3.38Å; Y116-Q119 PolarHBondContact O-N 3.36Å; Y116-Q119 VanDerWaalsContact O-N 3.1Å; Y116-Q120 HydrophobicContact CD1-CG 4.21Å; Y116-Q120 HydrophobicContact CE1-CG 3.8Å; Y116-Q120 HydrophobicContact CE2-CG 4.31Å; Y116-Q120 WeakPolarHBondContact O-CG 3.29Å; Y116-Q120 PolarHBondContact O-N 3.25Å
117	E	92.3	Very high	87.6	Confident	1 Å²	1	37.9 Å²	37.9	1%	0.005	20%	0.203	C	C	.	.	H	α-helix	trans	-58.8	-44.1	176.7	-174.4	65.4	-157.7	0	0	111.6	R31 W33 T34 M86 I92 Q113 M114 H115 Q119 Q120 I121	R31-E117 IonicContact CZ-OE1 2.78Å; R31-E117 IonicContact NH1-OE1 3.91Å; R31-E117 PolarHBondContact NH1-OE1 3.49Å; R31-E117 IonicContact NH2-OE1 3.67Å; R31-E117 PolarHBondContact NH2-OE1 3.22Å; W33-E117 HydrophobicContact CE3-CB 3.86Å; W33-E117 HydrophobicContact CE3-CG 3.67Å; W33-E117 HydrophobicContact CZ3-CB 3.86Å; W33-E117 HydrophobicContact CZ3-CG 3.72Å; T34-E117 VanDerWaalsContact CB-OE2 3.23Å; T34-E117 WeakPolarHBondContact CB-OE2 3.27Å; T34-E117 PolarHBondContact N-OE2 2.82Å; T34-E117 PolarHBondContact OG1-OE1 2.99Å; T34-E117 PolarHBondContact OG1-OE2 3.43Å; M86-E117 HydrophobicContact SD-CB 4.33Å; M86-E117 HydrophobicContact SD-CG 4.21Å; I92-E117 HydrophobicContact CD1-CG 3.94Å; Q113-E117 VanDerWaalsContact O-CB 3.27Å; Q113-E117 WeakPolarHBondContact O-CB 3.36Å; Q113-E117 PolarHBondContact O-N 3.4Å; M114-E117 PolarHBondContact O-N 2.93Å; H115-E117 PolarHBondContact O-N 3.42Å; E117-Q119 VanDerWaalsContact C-N 3.25Å; E117-Q119 PolarHBondContact O-N 3.46Å; E117-Q120 PolarHBondContact O-N 2.81Å; E117-I121 HydrophobicContact CG-CD1 3.78Å; E117-I121 HydrophobicContact CG-CG1 4.45Å; E117-I121 VanDerWaalsContact O-CG1 3.29Å; E117-I121 WeakPolarHBondContact O-CG1 3.05Å; E117-I121 PolarHBondContact O-N 3.42Å
118	A	91.9	Very high	86.2	Confident	0 Å²	0	39.5 Å²	39.5	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-59.9	-34	175.7	0	0	0	0	0	112.9	L61 M86 M114 H115 Y116 G122 V123 I124	L61-A118 HydrophobicContact CD2-CB 4.1Å; M86-A118 HydrophobicContact CE-CB 3.89Å; M114-A118 WeakPolarHBondContact O-CB 3.31Å; M114-A118 PolarHBondContact O-N 3.38Å; H115-A118 WeakPolarHBondContact O-CB 3.48Å; H115-A118 PolarHBondContact O-N 2.94Å; Y116-A118 VanDerWaalsContact C-N 3.32Å; Y116-A118 PolarHBondContact O-N 2.95Å; A118-G122 PolarHBondContact O-N 3.49Å; A118-G122 VanDerWaalsContact O-N 3.07Å; A118-V123 HydrophobicContact CB-CG2 3.79Å; A118-V123 WeakPolarHBondContact O-CG2 3.26Å; A118-V123 PolarHBondContact O-N 3.36Å; A118-I124 HydrophobicContact CB-CB 4.13Å; A118-I124 HydrophobicContact CB-CD1 3.57Å; A118-I124 HydrophobicContact CB-CG1 3.8Å; A118-I124 PolarHBondContact O-N 3.46Å
119	Q	89.5	Confident	84.7	Confident	16 Å²	16	40.1 Å²	40.1	8%	0.075	21%	0.214	C	C	.	.	H	α-helix	trans	-73.4	-32.3	172.5	-70.7	-174.7	-14.2	0	0	113.5	W46 H115 Y116 E117 G122 I124 E125 K126	W46-Q119 HydrophobicContact CH2-CG 4.45Å; H115-Q119 PolarHBondContact CE1-NE2 3.36Å; H115-Q119 PolarHBondContact O-N 2.98Å; Y116-Q119 WeakPolarHBondContact O-CB 3.38Å; Y116-Q119 PolarHBondContact O-N 3.36Å; Y116-Q119 VanDerWaalsContact O-N 3.1Å; E117-Q119 VanDerWaalsContact C-N 3.25Å; E117-Q119 PolarHBondContact O-N 3.46Å; Q119-G122 PolarHBondContact O-N 3.18Å; Q119-I124 WeakPolarHBondContact CA-O 3.19Å; Q119-I124 HydrophobicContact CG-CB 4.13Å; Q119-I124 HydrophobicContact CG-CG2 3.96Å; Q119-E125 PolarHBondContact NE2-O 3.17Å; Q119-K126 HydrophobicContact CB-CG 4.14Å; Q119-K126 HydrophobicContact CG-CG 4.36Å
120	Q	90.2	Very high	83.2	Confident	76 Å²	76	42.2 Å²	42.2	36%	0.355	23%	0.23	S	C	.	.	H	α-helix	trans	-72.3	-37.5	175.3	-61.7	-47.9	-48.7	0	0	111.8	T34 Y116 E117 G122	T34-Q120 HydrophobicContact CG2-CG 4.05Å; Y116-Q120 HydrophobicContact CD1-CG 4.21Å; Y116-Q120 HydrophobicContact CE1-CG 3.8Å; Y116-Q120 HydrophobicContact CE2-CG 4.31Å; Y116-Q120 WeakPolarHBondContact O-CG 3.29Å; Y116-Q120 PolarHBondContact O-N 3.25Å; E117-Q120 PolarHBondContact O-N 2.81Å; Q120-G122 PolarHBondContact O-N 3.39Å
121	I	90.6	Very high	81.7	Confident	52 Å²	52	46.2 Å²	46.2	27%	0.267	25%	0.251	S	S	.	.	H	α-helix	trans	-69.6	-26.8	173.9	-63.2	162.6	0	0	0	110.9	Y90 E117 V123	Y90-I121 HydrophobicContact CD1-CD1 4.12Å; Y90-I121 HydrophobicContact CD1-CG2 3.62Å; Y90-I121 HydrophobicContact CD2-CD1 3.72Å; Y90-I121 HydrophobicContact CE1-CG2 3.55Å; Y90-I121 HydrophobicContact CE2-CD1 4.27Å; Y90-I121 HydrophobicContact CG-CD1 3.63Å; Y90-I121 HydrophobicContact CG-CG2 4.27Å; E117-I121 HydrophobicContact CG-CD1 3.78Å; E117-I121 HydrophobicContact CG-CG1 4.45Å; E117-I121 VanDerWaalsContact O-CG1 3.29Å; E117-I121 WeakPolarHBondContact O-CG1 3.05Å; E117-I121 PolarHBondContact O-N 3.42Å; I121-V123 HydrophobicContact CG2-CG1 4.04Å
122	G	88.8	Confident	80.1	Confident	59 Å²	59	46.4 Å²	46.4	61%	0.608	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	89.4	18.8	180	0	0	0	0	0	114.3	A118 Q119 Q120	A118-G122 PolarHBondContact O-N 3.49Å; A118-G122 VanDerWaalsContact O-N 3.07Å; Q119-G122 PolarHBondContact O-N 3.18Å; Q120-G122 PolarHBondContact O-N 3.39Å
123	V	88.8	Confident	78.5	Confident	53 Å²	53	48.3 Å²	48.3	32%	0.321	27%	0.265	S	S	.	.	S	Bend	trans	-91.2	-11.4	173.7	-62.5	0	0	0	0	113.6	A64 Y90 A118 I121	A64-V123 HydrophobicContact CB-CB 4.37Å; A64-V123 HydrophobicContact CB-CG2 4.12Å; Y90-V123 HydrophobicContact CE1-CG1 4.32Å; Y90-V123 VanDerWaalsContact OH-CG1 3.27Å; Y90-V123 WeakPolarHBondContact OH-CG1 3.37Å; A118-V123 HydrophobicContact CB-CG2 3.79Å; A118-V123 WeakPolarHBondContact O-CG2 3.26Å; A118-V123 PolarHBondContact O-N 3.36Å; I121-V123 HydrophobicContact CG2-CG1 4.04Å
124	I	87.6	Confident	76.9	Confident	17 Å²	17	53.7 Å²	53.7	9%	0.087	29%	0.294	C	S	.	.	S	Bend	trans	-126.1	135.3	169.3	-67.1	-179.2	0	0	0	108.6	Q60 L61 A64 A118 Q119	Q60-I124 HydrophobicContact CB-CD1 4.16Å; L61-I124 HydrophobicContact CD2-CD1 4Å; L61-I124 HydrophobicContact CG-CD1 4.49Å; A64-I124 HydrophobicContact CB-CD1 3.84Å; A64-I124 HydrophobicContact CB-CG1 3.5Å; A64-I124 VanDerWaalsContact CB-CG1 3.5Å; A118-I124 HydrophobicContact CB-CB 4.13Å; A118-I124 HydrophobicContact CB-CD1 3.57Å; A118-I124 HydrophobicContact CB-CG1 3.8Å; A118-I124 PolarHBondContact O-N 3.46Å; Q119-I124 WeakPolarHBondContact CA-O 3.19Å; Q119-I124 HydrophobicContact CG-CB 4.13Å; Q119-I124 HydrophobicContact CG-CG2 3.96Å
125	E	81.6	Confident	75.1	Confident	132 Å²	132	60.3 Å²	60.3	62%	0.617	33%	0.325	S	S	*	.			trans	-66.4	142.2	174.8	-67.1	176.8	165	0	0	111.7	Q119 K127	Q119-E125 PolarHBondContact NE2-O 3.17Å; E125-K127 HydrophobicContact CB-CG 4.32Å; E125-K127 PolarHBondContact O-N 2.99Å; E125-K127 WeakPolarHBondContact OE2-CE 3.44Å; E125-K127 IonicContact OE2-NZ 3.7Å; E125-K127 PolarHBondContact OE2-NZ 3.17Å
126	K	73.4	Confident	73.2	Confident	153 Å²	153	60.7 Å²	60.7	67%	0.665	33%	0.328	S	S	*	.			trans	-72.1	89.1	172.2	-67.5	178.7	-177.8	175.5	0	109.5	Q119	Q119-K126 HydrophobicContact CB-CG 4.14Å; Q119-K126 HydrophobicContact CG-CG 4.36Å
127	K	66	Low	71.3	Confident	100 Å²	100	62.4 Å²	62.4	44%	0.435	34%	0.344	S	S	.	.			trans	-103.3	145.7	173.7	-67.7	-176	177.8	162.6	0	110.5	E125 D131	E125-K127 HydrophobicContact CB-CG 4.32Å; E125-K127 PolarHBondContact O-N 2.99Å; E125-K127 WeakPolarHBondContact OE2-CE 3.44Å; E125-K127 IonicContact OE2-NZ 3.7Å; E125-K127 PolarHBondContact OE2-NZ 3.17Å; K127-D131 HydrophobicContact CB-CB 4.34Å
128	T	57.7	Low	69	Low	73 Å²	73	67 Å²	67	45%	0.448	37%	0.373	S	S	.	.			trans	-69.6	158.4	171.4	69.2	0	0	0	0	110.2	S130 D131 A132	T128-S130 PolarHBondContact O-N 3.15Å; T128-S130 PolarHBondContact OG1-OG 3.17Å; T128-D131 PolarHBondContact O-N 3.42Å; T128-D131 PolarHBondContact OG1-N 3.43Å; T128-D131 PolarHBondContact OG1-OD2 2.89Å; T128-A132 WeakPolarHBondContact O-CB 3.48Å; T128-A132 PolarHBondContact O-N 2.71Å
129	C	55	Low	66.3	Low	37 Å²	37	70.9 Å²	70.9	25%	0.25	40%	0.398	C	S	.	.	H	α-helix	trans	-56.9	-36.4	177.1	-175.1	0	0	0	0	111.9	F49 C133	F49-C129 HydrophobicContact CD2-CB 4.49Å; C129-C133 WeakPolarHBondContact O-CB 3.27Å; C129-C133 PolarHBondContact O-N 3.38Å
130	S	58.5	Low	63.8	Low	72 Å²	72	77.4 Å²	77.4	50%	0.503	42%	0.424	S	S	.	.	H	α-helix	trans	-66.1	-44	176.5	44.1	0	0	0	0	112.3	T128 C133 N134	T128-S130 PolarHBondContact O-N 3.15Å; T128-S130 PolarHBondContact OG1-OG 3.17Å; S130-C133 PolarHBondContact O-N 3.13Å; S130-N134 WeakPolarHBondContact O-CB 3.49Å; S130-N134 VanDerWaalsContact O-CG 3.31Å; S130-N134 PolarHBondContact O-N 3.3Å; S130-N134 PolarHBondContact O-ND2 2.87Å
131	D	60.5	Low	61.2	Low	84 Å²	84	87.5 Å²	87.5	45%	0.449	46%	0.458	S	S	.	.	H	α-helix	trans	-67.9	-40.1	179.6	-58.1	-34.1	0	0	0	111.2	K127 T128 H135	K127-D131 HydrophobicContact CB-CB 4.34Å; T128-D131 PolarHBondContact O-N 3.42Å; T128-D131 PolarHBondContact OG1-N 3.43Å; T128-D131 PolarHBondContact OG1-OD2 2.89Å; D131-H135 PolarHBondContact O-N 3.42Å
132	A	56.7	Low	59.7	Low	3 Å²	3	89.3 Å²	89.3	3%	0.025	47%	0.468	C	S	.	.	H	α-helix	trans	-67.5	-41.2	176.6	0	0	0	0	0	112	F49 T128 H135 C136	F49-A132 HydrophobicContact CD2-CB 4.45Å; F49-A132 HydrophobicContact CE2-CB 3.5Å; F49-A132 VanDerWaalsContact CE2-CB 3.5Å; F49-A132 HydrophobicContact CZ-CB 3.82Å; T128-A132 WeakPolarHBondContact O-CB 3.48Å; T128-A132 PolarHBondContact O-N 2.71Å; A132-H135 PolarHBondContact O-N 3.15Å; A132-C136 WeakPolarHBondContact O-CB 3.29Å; A132-C136 PolarHBondContact O-N 3.16Å; A132-C136 PolarHBondContact O-SG 3.46Å; A132-C136 VanDerWaalsContact O-SG 3.37Å
133	C	56.1	Low	58.2	Low	40 Å²	40	90.9 Å²	90.9	27%	0.27	46%	0.461	S	S	.	.	H	α-helix	trans	-67.4	-46.5	178.6	-171.5	0	0	0	0	111.7	C129 S130 H135 C136 C137	C129-C133 WeakPolarHBondContact O-CB 3.27Å; C129-C133 PolarHBondContact O-N 3.38Å; S130-C133 PolarHBondContact O-N 3.13Å; C133-H135 PolarHBondContact O-N 3.25Å; C133-C136 PolarHBondContact O-N 3.35Å; C133-C137 VanDerWaalsContact O-CB 3.29Å; C133-C137 WeakPolarHBondContact O-CB 3.35Å; C133-C137 PolarHBondContact O-N 3.24Å
134	N	59	Low	56.5	Low	120 Å²	120	93 Å²	93	64%	0.642	47%	0.468	S	S	*	.	H	α-helix	trans	-59.8	-33.2	177.3	-77	-26.6	0	0	0	112.6	S130 V138	S130-N134 WeakPolarHBondContact O-CB 3.49Å; S130-N134 VanDerWaalsContact O-CG 3.31Å; S130-N134 PolarHBondContact O-N 3.3Å; S130-N134 PolarHBondContact O-ND2 2.87Å; N134-V138 WeakPolarHBondContact O-CG2 3.3Å
135	H	53.6	Low	54.7	Low	138 Å²	138	97.5 Å²	97.5	64%	0.639	49%	0.491	S	S	*	.	H	α-helix	trans	-87.8	-33.4	179.1	-156.4	72.2	0	0	0	113.4	D131 A132 C133	D131-H135 PolarHBondContact O-N 3.42Å; A132-H135 PolarHBondContact O-N 3.15Å; C133-H135 PolarHBondContact O-N 3.25Å
136	C	50.2	Low	53	Low	12 Å²	12	95.3 Å²	95.3	8%	0.081	48%	0.483	C	S	.	.	H	α-helix	trans	-89.8	-30.4	-175.7	-66.8	0	0	0	0	114.6	C56 Q60 A132 C133 V138 C139	C56-C136 HydrophobicContact CB-CB 3.41Å; C56-C136 VanDerWaalsContact CB-CB 3.41Å; C56-C136 WeakPolarHBondContact SG-CB 3.36Å; Q60-C136 PolarHBondContact NE2-SG 3.03Å; Q60-C136 VanDerWaalsContact NE2-SG 3.45Å; A132-C136 WeakPolarHBondContact O-CB 3.29Å; A132-C136 PolarHBondContact O-N 3.16Å; A132-C136 PolarHBondContact O-SG 3.46Å; A132-C136 VanDerWaalsContact O-SG 3.37Å; C133-C136 PolarHBondContact O-N 3.35Å; C136-V138 PolarHBondContact O-N 3.35Å; C136-C139 WeakPolarHBondContact O-CB 3.44Å; C136-C139 PolarHBondContact O-N 3.48Å; C136-C139 VanDerWaalsContact O-N 3.09Å
137	C	48.5	Very low	51.6	Low	72 Å²	72	91.5 Å²	91.5	49%	0.486	47%	0.471	S	S	.	.	G	3₁₀ helix	trans	-64.6	-25.6	172.2	-73.2	0	0	0	0	111.8	C133 C139 Y140	C133-C137 VanDerWaalsContact O-CB 3.29Å; C133-C137 WeakPolarHBondContact O-CB 3.35Å; C133-C137 PolarHBondContact O-N 3.24Å; C137-C139 VanDerWaalsContact C-N 3.29Å; C137-C139 PolarHBondContact O-N 3.49Å; C137-Y140 PolarHBondContact O-N 3.07Å
138	V	44.4	Very low	50.6	Low	99 Å²	99	90.9 Å²	90.9	60%	0.6	47%	0.473	S	S	*	.	G	3₁₀ helix	trans	-69.5	-26	174.4	-177.7	0	0	0	0	111.8	N134 C136 Y140 R141	N134-V138 WeakPolarHBondContact O-CG2 3.3Å; C136-V138 PolarHBondContact O-N 3.35Å; V138-Y140 PolarHBondContact O-N 2.79Å; V138-R141 PolarHBondContact O-N 3.01Å
139	C	35.5	Very low	50	Low	80 Å²	80	92.2 Å²	92.2	54%	0.541	48%	0.475	S	S	.	.	G	3₁₀ helix	trans	-73.5	-10.9	176.9	-66.1	0	0	0	0	114.4	C136 C137	C136-C139 WeakPolarHBondContact O-CB 3.44Å; C136-C139 PolarHBondContact O-N 3.48Å; C136-C139 VanDerWaalsContact O-N 3.09Å; C137-C139 VanDerWaalsContact C-N 3.29Å; C137-C139 PolarHBondContact O-N 3.49Å
140	Y	38.1	Very low	49.6	Very low	154 Å²	154	96.8 Å²	96.8	60%	0.604	49%	0.494	S	S	*	.	G	3₁₀ helix	trans	-104	10.7	176.6	-77.8	-79.5	0	0	0	113.3	F55 C137 V138	F55-Y140 HydrophobicContact CB-CE2 4.39Å; F55-Y140 WeakPolarHBondContact CB-OH 3.36Å; C137-Y140 PolarHBondContact O-N 3.07Å; V138-Y140 PolarHBondContact O-N 2.79Å
141	R	34.6	Very low	48.8	Very low	288 Å²	288	99.1 Å²	99.1	100%	1.087	49%	0.493	S	S	*	.			trans	-111.4	0	171.3	-154.4	-176.5	-148.3	-149.2	5.5	110	V138	V138-R141 PolarHBondContact O-N 3.01Å

Retrieved 141 of 141 residues in 148 ms (Link to these results)

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