A0A077ZDB6_TRITR Loading...

Troponin I 2

AlphaFold DB , UniProt , Accession A0A077ZDB6, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 259 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	40.9	Very low	42.4	Very low	252 Å²	252	159.9 Å²	159.9	100%	1.241	80%	0.799	S	S	*	*				0	120	0	-98.6	162.6	177.9	0	0	108.1
2	S	42.4	Very low	42.1	Very low	100 Å²	100	159.2 Å²	159.2	70%	0.699	80%	0.799	S	S	*	*			trans	-47.1	139.3	176.9	-123.8	0	0	0	0	112.6
3	R	46.5	Very low	42.1	Very low	227 Å²	227	158.7 Å²	158.7	86%	0.857	80%	0.798	S	S	*	*			trans	-167.4	87.9	132.4	-105.3	-179.1	-75.5	169.6	-3.8	108.8	F5	R3-F5 PolarHBondContact O-N 2.82Å
4	Y	42.6	Very low	42	Very low	192 Å²	192	153.9 Å²	153.9	75%	0.753	80%	0.796	S	S	*	*			trans	-47.6	125.7	146	-76.1	-100.5	0	0	0	108.2
5	F	39.5	Very low	41.5	Very low	160 Å²	160	148.5 Å²	148.5	70%	0.702	79%	0.792	S	S	*	*			trans	-134.4	79.9	159.6	-120.8	-91.8	0	0	0	106.3	R3 E7	R3-F5 PolarHBondContact O-N 2.82Å; F5-E7 HydrophobicContact CD1-CG 3.96Å; F5-E7 HydrophobicContact CE1-CG 4.03Å; F5-E7 WeakPolarHBondContact CE1-OE1 3.48Å
6	E	40.9	Very low	41.6	Very low	157 Å²	157	149.3 Å²	149.3	73%	0.734	80%	0.796	S	S	*	*			trans	-71.5	106.8	156.1	-129.7	106.8	-168.6	0	0	106
7	E	43.6	Very low	41.6	Very low	160 Å²	160	149.5 Å²	149.5	75%	0.748	79%	0.791	S	S	*	*			trans	-126.8	87.8	160.3	-84.4	-169.9	167.7	0	0	107.9	F5 G9	F5-E7 HydrophobicContact CD1-CG 3.96Å; F5-E7 HydrophobicContact CE1-CG 4.03Å; F5-E7 WeakPolarHBondContact CE1-OE1 3.48Å; E7-G9 VanDerWaalsContact C-N 3.34Å; E7-G9 PolarHBondContact O-N 3.37Å; E7-G9 VanDerWaalsContact O-N 3.1Å
8	E	45	Very low	41.4	Very low	175 Å²	175	147.1 Å²	147.1	82%	0.818	79%	0.788	S	S	*	*			trans	-64.3	92.6	160.1	-73.7	-91.8	139.9	0	0	108.1	V10	E8-V10 PolarHBondContact O-N 3.12Å
9	G	42.4	Very low	41.3	Very low	74 Å²	74	146.6 Å²	146.6	76%	0.763	78%	0.781	S	S	*	*			trans	-74.8	97.3	168.5	0	0	0	0	0	110	E7 L11	E7-G9 VanDerWaalsContact C-N 3.34Å; E7-G9 PolarHBondContact O-N 3.37Å; E7-G9 VanDerWaalsContact O-N 3.1Å; G9-L11 PolarHBondContact O-N 3.29Å
10	V	44.8	Very low	41.2	Very low	121 Å²	121	147.6 Å²	147.6	73%	0.733	78%	0.781	S	S	*	*			trans	-61.3	126	174.8	-177.2	0	0	0	0	109.5	E8 D12	E8-V10 PolarHBondContact O-N 3.12Å; V10-D12 PolarHBondContact O-N 2.98Å
11	L	37.4	Very low	41.1	Very low	141 Å²	141	147.5 Å²	147.5	74%	0.738	78%	0.781	S	S	*	*			trans	-79.2	92.3	-178.9	-156.9	94.9	0	0	0	108.8	G9 I13	G9-L11 PolarHBondContact O-N 3.29Å; L11-I13 HydrophobicContact CD2-CD1 3.6Å; L11-I13 HydrophobicContact CD2-CG1 3.91Å; L11-I13 HydrophobicContact CG-CG1 4.36Å; L11-I13 PolarHBondContact O-N 3.23Å
12	D	39.4	Very low	41.2	Very low	151 Å²	151	141.2 Å²	141.2	81%	0.807	75%	0.752	S	S	*	*			trans	-73.1	99.2	172.6	-80.1	-22	0	0	0	110.1	V10	V10-D12 PolarHBondContact O-N 2.98Å
13	I	41.5	Very low	41.2	Very low	153 Å²	153	144.5 Å²	144.5	79%	0.785	76%	0.762	S	S	*	*			trans	-99.4	86.6	164.3	-59.4	177.6	0	0	0	107.1	L11	L11-I13 HydrophobicContact CD2-CD1 3.6Å; L11-I13 HydrophobicContact CD2-CG1 3.91Å; L11-I13 HydrophobicContact CG-CG1 4.36Å; L11-I13 PolarHBondContact O-N 3.23Å
14	A	42	Very low	41.1	Very low	92 Å²	92	143 Å²	143	76%	0.76	77%	0.765	S	S	*	*			trans	-144	109.9	158	0	0	0	0	0	105
15	G	34.2	Very low	41.1	Very low	72 Å²	72	140.2 Å²	140.2	74%	0.742	76%	0.763	S	S	*	*				80.6	63.7	59.2	0	0	0	0	0	108.6
16	N	42	Very low	41.1	Very low	161 Å²	161	137.4 Å²	137.4	86%	0.861	76%	0.763	S	S	*	*			trans	-140.1	90.4	158	-109.5	18.8	0	0	0	107.6	S18	N16-S18 VanDerWaalsContact C-N 3.32Å; N16-S18 PolarHBondContact O-N 3.19Å; N16-S18 VanDerWaalsContact O-N 3.15Å
17	H	42.5	Very low	41.1	Very low	153 Å²	153	134 Å²	134	71%	0.708	76%	0.755	S	S	*	*			trans	-71.5	91.7	163.9	-172.4	66.1	0	0	0	106.4	E19	H17-E19 VanDerWaalsContact C-N 3.33Å; H17-E19 IonicContact CD2-OE1 3.76Å; H17-E19 IonicContact CD2-OE2 2.66Å; H17-E19 IonicContact CE1-OE1 3.77Å; H17-E19 VanDerWaalsContact NE2-CG 3.29Å; H17-E19 WeakPolarHBondContact NE2-CG 3.31Å; H17-E19 IonicContact NE2-OE1 3.01Å; H17-E19 PolarHBondContact NE2-OE1 2.98Å; H17-E19 IonicContact NE2-OE2 2.87Å; H17-E19 PolarHBondContact O-N 3.3Å; H17-E19 VanDerWaalsContact O-N 3.14Å
18	S	38.1	Very low	41	Very low	106 Å²	106	133.5 Å²	133.5	74%	0.741	76%	0.758	S	S	*	*			trans	-78.5	84.1	172.8	54.5	0	0	0	0	108.7	N16 E20	N16-S18 VanDerWaalsContact C-N 3.32Å; N16-S18 PolarHBondContact O-N 3.19Å; N16-S18 VanDerWaalsContact O-N 3.15Å; S18-E20 PolarHBondContact O-N 3.15Å
19	E	38.6	Very low	41.1	Very low	139 Å²	139	132.5 Å²	132.5	65%	0.65	76%	0.756	S	S	*	*			trans	-84.3	72.7	157.8	-81.5	176.2	178.6	0	0	107.7	H17 N21	H17-E19 VanDerWaalsContact C-N 3.33Å; H17-E19 IonicContact CD2-OE1 3.76Å; H17-E19 IonicContact CD2-OE2 2.66Å; H17-E19 IonicContact CE1-OE1 3.77Å; H17-E19 VanDerWaalsContact NE2-CG 3.29Å; H17-E19 WeakPolarHBondContact NE2-CG 3.31Å; H17-E19 IonicContact NE2-OE1 3.01Å; H17-E19 PolarHBondContact NE2-OE1 2.98Å; H17-E19 IonicContact NE2-OE2 2.87Å; H17-E19 PolarHBondContact O-N 3.3Å; H17-E19 VanDerWaalsContact O-N 3.14Å; E19-N21 PolarHBondContact O-N 2.88Å
20	E	40.5	Very low	41.5	Very low	166 Å²	166	133.7 Å²	133.7	78%	0.776	75%	0.751	S	S	*	*			trans	-90.4	93.5	166.6	-132.2	170.5	-166.3	0	0	107.1	S18 N22	S18-E20 PolarHBondContact O-N 3.15Å; E20-N22 PolarHBondContact O-N 3.37Å; E20-N22 VanDerWaalsContact O-N 3.1Å
21	N	39.4	Very low	41.3	Very low	146 Å²	146	137.1 Å²	137.1	78%	0.781	76%	0.759	S	S	*	*			trans	-64	99.4	167.7	-61.9	-65.5	0	0	0	107.8	E19	E19-N21 PolarHBondContact O-N 2.88Å
22	N	41.3	Very low	41.6	Very low	120 Å²	120	137.9 Å²	137.9	64%	0.642	76%	0.763	S	S	*	*			trans	-142.8	70.7	172.2	-82.8	-39.9	0	0	0	108.7	E20	E20-N22 PolarHBondContact O-N 3.37Å; E20-N22 VanDerWaalsContact O-N 3.1Å
23	D	43.9	Very low	41.5	Very low	169 Å²	169	139 Å²	139	90%	0.904	76%	0.763	S	S	*	*			trans	-137.8	52.5	166.5	-70.3	-50.2	0	0	0	108.7
24	E	43.2	Very low	41.4	Very low	195 Å²	195	143.1 Å²	143.1	91%	0.911	77%	0.771	S	S	*	*			trans	-102.7	51.7	161	-72.3	-172.6	178.4	0	0	109	S26	E24-S26 VanDerWaalsContact C-N 3.29Å; E24-S26 PolarHBondContact O-N 3.19Å
25	D	43.2	Very low	41.3	Very low	134 Å²	134	150 Å²	150	72%	0.717	78%	0.777	S	S	*	*			trans	-88.2	82.7	161.8	-154.2	-6.3	0	0	0	108.1	C27	D25-C27 PolarHBondContact O-N 3.17Å; D25-C27 PolarHBondContact OD1-SG 3.21Å; D25-C27 VanDerWaalsContact OD1-SG 3.34Å
26	S	39	Very low	41.7	Very low	100 Å²	100	154.7 Å²	154.7	70%	0.699	79%	0.785	S	S	*	*			trans	-64.6	69.7	164.1	170.7	0	0	0	0	108.8	E24 D28	E24-S26 VanDerWaalsContact C-N 3.29Å; E24-S26 PolarHBondContact O-N 3.19Å; S26-D28 PolarHBondContact O-N 3.22Å; S26-D28 VanDerWaalsContact O-N 3.1Å
27	C	41.2	Very low	41.7	Very low	86 Å²	86	150 Å²	150	58%	0.581	77%	0.774	S	S	*	*			trans	-71.9	101.8	164.8	-80.8	0	0	0	0	107.5	D25 I29	D25-C27 PolarHBondContact O-N 3.17Å; D25-C27 PolarHBondContact OD1-SG 3.21Å; D25-C27 VanDerWaalsContact OD1-SG 3.34Å; C27-I29 PolarHBondContact O-N 3.4Å
28	D	42.4	Very low	41.3	Very low	150 Å²	150	146.6 Å²	146.6	80%	0.802	78%	0.781	S	S	*	*			trans	-44.8	103.6	165.8	-80.1	-49.9	0	0	0	109.4	S26 P30	S26-D28 PolarHBondContact O-N 3.22Å; S26-D28 VanDerWaalsContact O-N 3.1Å; D28-P30 WeakPolarHBondContact O-CD 3.49Å
29	I	46.9	Very low	41.4	Very low	153 Å²	153	143.7 Å²	143.7	79%	0.785	77%	0.768	S	S	*	*			trans	-73.3	114.7	174.1	-62.2	-175.3	0	0	0	106.4	C27 E31	C27-I29 PolarHBondContact O-N 3.4Å; I29-E31 PolarHBondContact O-N 2.92Å
30	P	49.7	Very low	42	Very low	99 Å²	99	142.2 Å²	142.2	64%	0.643	77%	0.77	S	S	*	*			trans	-59.2	134	171.2	-18.1	32.3	0	0	0	108	D28 L32	D28-P30 WeakPolarHBondContact O-CD 3.49Å; P30-L32 PolarHBondContact O-N 3.37Å
31	E	40.5	Very low	42.5	Very low	194 Å²	194	141.8 Å²	141.8	91%	0.907	77%	0.768	S	S	*	*			trans	-54	82.6	177.5	-167.5	154.3	-172	0	0	110.6	I29 Q33	I29-E31 PolarHBondContact O-N 2.92Å; E31-Q33 PolarHBondContact O-N 2.91Å; E31-Q33 VanDerWaalsContact O-N 3.15Å
32	L	44	Very low	43.1	Very low	156 Å²	156	139.5 Å²	139.5	82%	0.817	76%	0.76	S	S	*	*			trans	-81.4	102.3	-180	-134.4	88.9	0	0	0	106.4	P30 Y34	P30-L32 PolarHBondContact O-N 3.37Å; L32-Y34 PolarHBondContact O-N 3.15Å
33	Q	38	Very low	43.7	Very low	175 Å²	175	140.7 Å²	140.7	82%	0.818	76%	0.761	S	S	*	*			trans	-33.2	122.3	173.2	-69	164.1	4.6	0	0	111.3	E31 R35	E31-Q33 PolarHBondContact O-N 2.91Å; E31-Q33 VanDerWaalsContact O-N 3.15Å; Q33-R35 VanDerWaalsContact C-N 3.28Å; Q33-R35 PolarHBondContact O-N 3.48Å
34	Y	39.7	Very low	44.5	Very low	240 Å²	240	137.3 Å²	137.3	94%	0.941	74%	0.743	S	S	*	*			trans	-44	93.3	164.2	-82.4	-103.3	0	0	0	109.3	L32 D36	L32-Y34 PolarHBondContact O-N 3.15Å; Y34-D36 PolarHBondContact O-N 3Å
35	R	39.9	Very low	45.7	Very low	237 Å²	237	132.7 Å²	132.7	89%	0.894	73%	0.725	S	S	*	*			trans	-95	86.6	166	-169.4	165.6	172.6	162.1	-4.4	106.3	Q33 G37	Q33-R35 VanDerWaalsContact C-N 3.28Å; Q33-R35 PolarHBondContact O-N 3.48Å; R35-G37 PolarHBondContact O-N 2.79Å
36	D	42.1	Very low	47.2	Very low	169 Å²	169	133 Å²	133	90%	0.904	72%	0.722	S	S	*	*			trans	-47.6	100	164.4	-160	13.8	0	0	0	108.2	Y34	Y34-D36 PolarHBondContact O-N 3Å
37	G	41.2	Very low	48.9	Very low	62 Å²	62	134.2 Å²	134.2	64%	0.639	72%	0.717	S	S	*	*			trans	-151.1	59.3	-164	0	0	0	0	0	109.5	R35 G39	R35-G37 PolarHBondContact O-N 2.79Å; G37-G39 PolarHBondContact O-N 2.84Å; G37-G39 VanDerWaalsContact O-N 3.08Å
38	G	34.7	Very low	50.5	Low	83 Å²	83	134.3 Å²	134.3	86%	0.856	71%	0.708	S	S	*	*			trans	-50.6	112.6	171.4	0	0	0	0	0	111.2
39	G	40.3	Very low	52.3	Low	45 Å²	45	133.1 Å²	133.1	46%	0.464	70%	0.698	S	S	.	*			trans	-126.5	103.9	168	0	0	0	0	0	107.8	G37 Q41	G37-G39 PolarHBondContact O-N 2.84Å; G37-G39 VanDerWaalsContact O-N 3.08Å; G39-Q41 PolarHBondContact O-N 3.31Å
40	P	50.1	Low	54.1	Low	108 Å²	108	127.8 Å²	127.8	70%	0.701	68%	0.677	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.2	15	-169.9	-18	31.3	0	0	0	115.9
41	Q	51.3	Low	55.7	Low	157 Å²	157	129.1 Å²	129.1	73%	0.734	67%	0.669	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100	-19.3	-174.9	-68.7	-171.4	-48.3	0	0	113.7	G39	G39-Q41 PolarHBondContact O-N 3.31Å
42	V	51.9	Low	57.7	Low	98 Å²	98	126.7 Å²	126.7	59%	0.594	65%	0.652	S	S	*	*	H	α-helix	trans	-82.5	-30.1	-174.4	-155.3	0	0	0	0	112	D44 D45 E46	V42-D44 VanDerWaalsContact C-N 3.34Å; V42-D45 PolarHBondContact O-N 3.46Å; V42-E46 PolarHBondContact O-N 2.98Å
43	E	55.5	Low	59.9	Low	145 Å²	145	125.1 Å²	125.1	68%	0.678	64%	0.638	S	S	*	*	H	α-helix	trans	-67	-35.6	175.9	-70.9	-178	156.5	0	0	111.8	D45 E46 E47	E43-D45 VanDerWaalsContact C-N 3.35Å; E43-D45 PolarHBondContact O-N 3.26Å; E43-E46 PolarHBondContact O-N 3Å; E43-E47 WeakPolarHBondContact O-CG 3.29Å; E43-E47 PolarHBondContact O-N 2.86Å; E43-E47 VanDerWaalsContact O-N 3.13Å
44	D	59.4	Low	62	Low	97 Å²	97	125 Å²	125	52%	0.519	63%	0.63	S	S	.	*	H	α-helix	trans	-64	-38.6	178	-78.1	-28.8	0	0	0	112	V42 E48	V42-D44 VanDerWaalsContact C-N 3.34Å; D44-E48 WeakPolarHBondContact O-CB 3.47Å; D44-E48 WeakPolarHBondContact O-CG 3.41Å; D44-E48 PolarHBondContact O-N 2.98Å
45	D	68	Low	64.4	Low	98 Å²	98	117.8 Å²	117.8	52%	0.524	61%	0.605	S	S	.	*	H	α-helix	trans	-66.3	-43.7	179	-77.3	-31.6	0	0	0	111.7	V42 E43 E48 E49	V42-D45 PolarHBondContact O-N 3.46Å; E43-D45 VanDerWaalsContact C-N 3.35Å; E43-D45 PolarHBondContact O-N 3.26Å; D45-E48 PolarHBondContact O-N 3.4Å; D45-E49 PolarHBondContact O-N 3.47Å
46	E	75.1	Confident	66.8	Low	142 Å²	142	111.3 Å²	111.3	66%	0.664	59%	0.585	S	S	*	*	H	α-helix	trans	-65.4	-40.1	178	-68.9	-170.4	173.8	0	0	112.2	V42 E43 E49 A50	V42-E46 PolarHBondContact O-N 2.98Å; E43-E46 PolarHBondContact O-N 3Å; E46-E49 PolarHBondContact O-N 2.9Å; E46-A50 WeakPolarHBondContact O-CB 3.43Å; E46-A50 PolarHBondContact O-N 3.48Å
47	E	75.8	Confident	68.9	Low	125 Å²	125	109.4 Å²	109.4	58%	0.584	57%	0.565	S	S	*	*	H	α-helix	trans	-66.1	-39.8	175.9	-74.1	-165.6	176.1	0	0	112.3	E43 A50 R51	E43-E47 WeakPolarHBondContact O-CG 3.29Å; E43-E47 PolarHBondContact O-N 2.86Å; E43-E47 VanDerWaalsContact O-N 3.13Å; E47-A50 PolarHBondContact O-N 3.46Å; E47-R51 WeakPolarHBondContact O-CB 3.45Å; E47-R51 PolarHBondContact O-N 3.42Å
48	E	74.6	Confident	71.3	Confident	87 Å²	87	113 Å²	113	41%	0.407	57%	0.565	S	S	.	*	H	α-helix	trans	-63.3	-43	175.3	-86.1	-165.1	-178.9	0	0	113	D44 D45 R51 R52	D44-E48 WeakPolarHBondContact O-CB 3.47Å; D44-E48 WeakPolarHBondContact O-CG 3.41Å; D44-E48 PolarHBondContact O-N 2.98Å; D45-E48 PolarHBondContact O-N 3.4Å; E48-R51 VanDerWaalsContact CG-NH2 3.28Å; E48-R51 PolarHBondContact O-N 3.28Å; E48-R52 PolarHBondContact O-N 3.23Å
49	E	80	Confident	73.9	Confident	125 Å²	125	117.5 Å²	117.5	58%	0.584	56%	0.556	S	S	*	*	H	α-helix	trans	-64.6	-40.4	174.9	-73.6	-163.4	164.2	0	0	111.9	D45 E46 R51 R52 K53	D45-E49 PolarHBondContact O-N 3.47Å; E46-E49 PolarHBondContact O-N 2.9Å; E49-R51 VanDerWaalsContact C-N 3.32Å; E49-R51 PolarHBondContact O-N 3.41Å; E49-R52 PolarHBondContact O-N 3.16Å; E49-K53 WeakPolarHBondContact O-CB 3.29Å; E49-K53 PolarHBondContact O-N 3.3Å
50	A	84.4	Confident	76.4	Confident	41 Å²	41	121.4 Å²	121.4	34%	0.339	56%	0.561	S	S	.	*	H	α-helix	trans	-62.9	-39.2	176.1	0	0	0	0	0	111.9	E46 E47 R54	E46-A50 WeakPolarHBondContact O-CB 3.43Å; E46-A50 PolarHBondContact O-N 3.48Å; E47-A50 PolarHBondContact O-N 3.46Å; A50-R54 VanDerWaalsContact O-CG 3.28Å; A50-R54 WeakPolarHBondContact O-CG 3.28Å; A50-R54 PolarHBondContact O-N 2.94Å
51	R	83.1	Confident	78.4	Confident	127 Å²	127	123.4 Å²	123.4	48%	0.479	56%	0.558	S	S	.	*	H	α-helix	trans	-65.4	-48.2	174.2	172.6	167.1	42.2	-133.5	-9.2	111.6	E47 E48 E49 K53 R54 E55	E47-R51 WeakPolarHBondContact O-CB 3.45Å; E47-R51 PolarHBondContact O-N 3.42Å; E48-R51 VanDerWaalsContact CG-NH2 3.28Å; E48-R51 PolarHBondContact O-N 3.28Å; E49-R51 VanDerWaalsContact C-N 3.32Å; E49-R51 PolarHBondContact O-N 3.41Å; R51-K53 VanDerWaalsContact C-N 3.31Å; R51-K53 PolarHBondContact O-N 2.99Å; R51-R54 PolarHBondContact O-N 3.3Å; R51-R54 VanDerWaalsContact O-N 3.11Å; R51-E55 WeakPolarHBondContact O-CG 3.44Å; R51-E55 PolarHBondContact O-N 2.93Å
52	R	82.9	Confident	80.3	Confident	144 Å²	144	118.8 Å²	118.8	54%	0.543	55%	0.547	S	S	.	.	H	α-helix	trans	-57	-43.4	175	-79.7	-171.6	-97.9	153.6	-6.5	111.9	E48 E49 R54 E55 E56	E48-R52 PolarHBondContact O-N 3.23Å; E49-R52 PolarHBondContact O-N 3.16Å; R52-R54 PolarHBondContact O-N 3.44Å; R52-E55 PolarHBondContact O-N 2.93Å; R52-E56 WeakPolarHBondContact O-CB 3.34Å; R52-E56 PolarHBondContact O-N 3.04Å
53	K	89.2	Confident	82.1	Confident	122 Å²	122	121 Å²	121	53%	0.53	55%	0.55	S	S	.	*	H	α-helix	trans	-66.4	-33.6	177.7	-164.9	175.3	-168.9	170.8	0	112.8	E49 R51 R57	E49-K53 WeakPolarHBondContact O-CB 3.29Å; E49-K53 PolarHBondContact O-N 3.3Å; R51-K53 VanDerWaalsContact C-N 3.31Å; R51-K53 PolarHBondContact O-N 2.99Å; K53-R57 VanDerWaalsContact O-CG 3.27Å; K53-R57 WeakPolarHBondContact O-CG 3.27Å; K53-R57 PolarHBondContact O-N 3.46Å
54	R	82.6	Confident	83.6	Confident	172 Å²	172	118.9 Å²	118.9	65%	0.649	55%	0.548	S	S	*	.	H	α-helix	trans	-70.2	-47.7	174	-73.3	171.9	-169	-169.4	5.6	111.1	A50 R51 R52 E56 R57 E58	A50-R54 VanDerWaalsContact O-CG 3.28Å; A50-R54 WeakPolarHBondContact O-CG 3.28Å; A50-R54 PolarHBondContact O-N 2.94Å; R51-R54 PolarHBondContact O-N 3.3Å; R51-R54 VanDerWaalsContact O-N 3.11Å; R52-R54 PolarHBondContact O-N 3.44Å; R54-E56 VanDerWaalsContact C-N 3.34Å; R54-E56 PolarHBondContact O-N 3.06Å; R54-R57 PolarHBondContact O-N 3.11Å; R54-E58 WeakPolarHBondContact O-CG 3.47Å; R54-E58 PolarHBondContact O-N 3.5Å
55	E	89.4	Confident	84.8	Confident	90 Å²	90	123.5 Å²	123.5	42%	0.421	56%	0.558	S	S	.	*	H	α-helix	trans	-61	-40.9	177.4	-72.8	-178.7	-165.4	0	0	112.2	R51 R52 E58 R59	R51-E55 WeakPolarHBondContact O-CG 3.44Å; R51-E55 PolarHBondContact O-N 2.93Å; R52-E55 PolarHBondContact O-N 2.93Å; E55-E58 PolarHBondContact O-N 2.88Å; E55-R59 WeakPolarHBondContact O-CG 3.22Å; E55-R59 PolarHBondContact O-N 3.32Å
56	E	90.3	Very high	85.7	Confident	101 Å²	101	125.8 Å²	125.8	47%	0.472	56%	0.563	S	S	.	*	H	α-helix	trans	-65.1	-41.5	177.5	-162.6	-165	160.7	0	0	111.5	R52 R54 E58 R59 K60	R52-E56 WeakPolarHBondContact O-CB 3.34Å; R52-E56 PolarHBondContact O-N 3.04Å; R54-E56 VanDerWaalsContact C-N 3.34Å; R54-E56 PolarHBondContact O-N 3.06Å; E56-E58 VanDerWaalsContact C-N 3.33Å; E56-E58 PolarHBondContact O-N 3.38Å; E56-R59 PolarHBondContact O-N 2.85Å; E56-K60 WeakPolarHBondContact O-CG 3.39Å; E56-K60 PolarHBondContact O-N 2.88Å; E56-K60 WeakPolarHBondContact OE1-CE 3.48Å; E56-K60 IonicContact OE1-NZ 3.4Å; E56-K60 PolarHBondContact OE1-NZ 3.49Å
57	R	86.9	Confident	86.2	Confident	128 Å²	128	128.4 Å²	128.4	48%	0.483	57%	0.567	S	S	.	*	H	α-helix	trans	-63.3	-38.9	173	-73.6	-178.9	-161.4	130.9	-12.5	111.7	K53 R54 K61	K53-R57 VanDerWaalsContact O-CG 3.27Å; K53-R57 WeakPolarHBondContact O-CG 3.27Å; K53-R57 PolarHBondContact O-N 3.46Å; R54-R57 PolarHBondContact O-N 3.11Å; R57-K61 WeakPolarHBondContact O-CB 3.43Å; R57-K61 VanDerWaalsContact O-CG 3.26Å; R57-K61 WeakPolarHBondContact O-CG 3.4Å; R57-K61 PolarHBondContact O-N 3.35Å
58	E	92.3	Very high	86.5	Confident	137 Å²	137	128.8 Å²	128.8	64%	0.64	57%	0.572	S	S	*	*	H	α-helix	trans	-68.8	-40.5	176.7	-73.8	-152.9	139.3	0	0	112.6	R54 E55 E56 K60 K61 A62	R54-E58 WeakPolarHBondContact O-CG 3.47Å; R54-E58 PolarHBondContact O-N 3.5Å; E55-E58 PolarHBondContact O-N 2.88Å; E56-E58 VanDerWaalsContact C-N 3.33Å; E56-E58 PolarHBondContact O-N 3.38Å; E58-K60 PolarHBondContact O-N 3.48Å; E58-K61 PolarHBondContact O-N 3Å; E58-A62 WeakPolarHBondContact O-CB 3.25Å; E58-A62 PolarHBondContact O-N 3.27Å
59	R	89.4	Confident	86.8	Confident	179 Å²	179	131.5 Å²	131.5	68%	0.675	59%	0.585	S	S	*	*	H	α-helix	trans	-59.6	-46.7	172.9	-74.4	-178.6	-170.5	-158.9	5.8	111.2	E55 E56 K61 A62 E63	E55-R59 WeakPolarHBondContact O-CG 3.22Å; E55-R59 PolarHBondContact O-N 3.32Å; E56-R59 PolarHBondContact O-N 2.85Å; R59-K61 VanDerWaalsContact C-N 3.35Å; R59-K61 PolarHBondContact O-N 3.4Å; R59-A62 PolarHBondContact O-N 2.87Å; R59-E63 WeakPolarHBondContact O-CB 3.38Å; R59-E63 PolarHBondContact O-N 2.91Å
60	K	92.9	Very high	86.8	Confident	127 Å²	127	131 Å²	131	55%	0.552	58%	0.583	S	S	*	*	H	α-helix	trans	-60	-42.9	174.9	-72.7	174.6	-176.1	169.9	0	111.6	E56 E58 E63 V64	E56-K60 WeakPolarHBondContact O-CG 3.39Å; E56-K60 PolarHBondContact O-N 2.88Å; E56-K60 WeakPolarHBondContact OE1-CE 3.48Å; E56-K60 IonicContact OE1-NZ 3.4Å; E56-K60 PolarHBondContact OE1-NZ 3.49Å; E58-K60 PolarHBondContact O-N 3.48Å; K60-E63 PolarHBondContact O-N 3.13Å; K60-V64 VanDerWaalsContact O-CG2 3.27Å; K60-V64 WeakPolarHBondContact O-CG2 3.45Å; K60-V64 PolarHBondContact O-N 2.93Å
61	K	91.5	Very high	86.5	Confident	150 Å²	150	131.7 Å²	131.7	65%	0.652	59%	0.588	S	S	*	*	H	α-helix	trans	-64.4	-42.6	175.8	-75.9	174.4	-178.4	-178.5	0	112.5	R57 E58 R59 E63 V64 R65	R57-K61 WeakPolarHBondContact O-CB 3.43Å; R57-K61 VanDerWaalsContact O-CG 3.26Å; R57-K61 WeakPolarHBondContact O-CG 3.4Å; R57-K61 PolarHBondContact O-N 3.35Å; E58-K61 PolarHBondContact O-N 3Å; R59-K61 VanDerWaalsContact C-N 3.35Å; R59-K61 PolarHBondContact O-N 3.4Å; K61-E63 VanDerWaalsContact C-N 3.34Å; K61-V64 PolarHBondContact O-N 3.48Å; K61-R65 WeakPolarHBondContact O-CB 3.49Å; K61-R65 PolarHBondContact O-N 2.93Å
62	A	90.5	Very high	85.9	Confident	60 Å²	60	126.8 Å²	126.8	50%	0.496	58%	0.577	S	S	.	*	H	α-helix	trans	-64.2	-40.8	178.3	0	0	0	0	0	111.2	E58 R59 R65 K66	E58-A62 WeakPolarHBondContact O-CB 3.25Å; E58-A62 PolarHBondContact O-N 3.27Å; R59-A62 PolarHBondContact O-N 2.87Å; A62-R65 PolarHBondContact O-N 3.4Å; A62-K66 WeakPolarHBondContact O-CB 3.37Å; A62-K66 PolarHBondContact O-N 3.33Å
63	E	91.4	Very high	85.2	Confident	143 Å²	143	128.2 Å²	128.2	67%	0.668	58%	0.582	S	S	*	*	H	α-helix	trans	-67.3	-43.2	176.5	-175	155.3	-178.6	0	0	112.4	R59 K60 K61 R65 K66 R67	R59-E63 WeakPolarHBondContact O-CB 3.38Å; R59-E63 PolarHBondContact O-N 2.91Å; K60-E63 PolarHBondContact O-N 3.13Å; K61-E63 VanDerWaalsContact C-N 3.34Å; E63-R65 VanDerWaalsContact C-N 3.3Å; E63-R65 PolarHBondContact O-N 3.25Å; E63-K66 PolarHBondContact O-N 3.19Å; E63-R67 WeakPolarHBondContact O-CB 3.3Å; E63-R67 PolarHBondContact O-N 2.86Å
64	V	87.1	Confident	84	Confident	102 Å²	102	125.3 Å²	125.3	62%	0.618	58%	0.581	S	S	*	*	H	α-helix	trans	-59.7	-42.3	173	170.4	0	0	0	0	111	K60 K61 R67 L68	K60-V64 VanDerWaalsContact O-CG2 3.27Å; K60-V64 WeakPolarHBondContact O-CG2 3.45Å; K60-V64 PolarHBondContact O-N 2.93Å; K61-V64 PolarHBondContact O-N 3.48Å; V64-R67 PolarHBondContact O-N 3.01Å; V64-L68 WeakPolarHBondContact O-CB 3.25Å; V64-L68 PolarHBondContact O-N 2.92Å
65	R	83	Confident	83.2	Confident	193 Å²	193	124.8 Å²	124.8	73%	0.728	58%	0.583	S	S	*	*	H	α-helix	trans	-64.1	-43.7	176.8	-170.5	177.8	179.2	-148.4	-0.4	112	K61 A62 E63 L68 E69	K61-R65 WeakPolarHBondContact O-CB 3.49Å; K61-R65 PolarHBondContact O-N 2.93Å; A62-R65 PolarHBondContact O-N 3.4Å; E63-R65 VanDerWaalsContact C-N 3.3Å; E63-R65 PolarHBondContact O-N 3.25Å; R65-L68 PolarHBondContact O-N 3.33Å; R65-E69 WeakPolarHBondContact O-CB 3.42Å; R65-E69 PolarHBondContact O-N 3.37Å
66	K	87.2	Confident	81.8	Confident	146 Å²	146	129 Å²	129	64%	0.635	60%	0.6	S	S	*	*	H	α-helix	trans	-62.5	-45.7	176.4	-174.7	-178.3	176.5	-173.7	0	111.5	A62 E63 L68 E69 E70	A62-K66 WeakPolarHBondContact O-CB 3.37Å; A62-K66 PolarHBondContact O-N 3.33Å; E63-K66 PolarHBondContact O-N 3.19Å; K66-L68 VanDerWaalsContact C-N 3.34Å; K66-L68 PolarHBondContact O-N 2.8Å; K66-E69 PolarHBondContact O-N 2.87Å; K66-E70 WeakPolarHBondContact O-CB 3.26Å; K66-E70 PolarHBondContact O-N 2.87Å
67	R	85.3	Confident	80.5	Confident	198 Å²	198	127.7 Å²	127.7	75%	0.747	61%	0.607	S	S	*	*	H	α-helix	trans	-62.3	-40.1	176.5	-172.5	176.3	179.1	-179.8	-0.1	111.9	E63 V64 A71	E63-R67 WeakPolarHBondContact O-CB 3.3Å; E63-R67 PolarHBondContact O-N 2.86Å; V64-R67 PolarHBondContact O-N 3.01Å; R67-A71 WeakPolarHBondContact O-CB 3.47Å; R67-A71 PolarHBondContact O-N 3.2Å
68	L	82.4	Confident	79.3	Confident	133 Å²	133	130.5 Å²	130.5	70%	0.696	62%	0.623	S	S	*	*	H	α-helix	trans	-67.2	-40.6	176.6	-167.6	74.2	0	0	0	111.8	V64 R65 K66 G72	V64-L68 WeakPolarHBondContact O-CB 3.25Å; V64-L68 PolarHBondContact O-N 2.92Å; R65-L68 PolarHBondContact O-N 3.33Å; K66-L68 VanDerWaalsContact C-N 3.34Å; K66-L68 PolarHBondContact O-N 2.8Å; L68-G72 PolarHBondContact O-N 2.9Å
69	E	80.6	Confident	77.7	Confident	143 Å²	143	133.4 Å²	133.4	67%	0.668	63%	0.633	S	S	*	*	H	α-helix	trans	-65.8	-42.5	176.4	-174.2	173	-170.3	0	0	112	R65 K66 G72 R73	R65-E69 WeakPolarHBondContact O-CB 3.42Å; R65-E69 PolarHBondContact O-N 3.37Å; K66-E69 PolarHBondContact O-N 2.87Å; E69-G72 CarbonylContact O-C 3.4Å; E69-G72 WeakPolarHBondContact O-CA 3.11Å; E69-G72 PolarHBondContact O-N 3.47Å; E69-R73 PolarHBondContact O-N 2.91Å
70	E	80.3	Confident	76.3	Confident	116 Å²	116	126.4 Å²	126.4	54%	0.542	62%	0.617	S	S	.	*	H	α-helix	trans	-66	-46.1	178.5	-173.6	164.4	-155.2	0	0	112.2	K66 G72 R73	K66-E70 WeakPolarHBondContact O-CB 3.26Å; K66-E70 PolarHBondContact O-N 2.87Å; E70-G72 PolarHBondContact O-N 3.45Å; E70-R73 PolarHBondContact O-N 3.23Å
71	A	78.6	Confident	74.9	Confident	54 Å²	54	130 Å²	130	45%	0.446	63%	0.633	S	S	.	*	H	α-helix	trans	-61.5	-34.5	171.9	0	0	0	0	0	111.9	R67	R67-A71 WeakPolarHBondContact O-CB 3.47Å; R67-A71 PolarHBondContact O-N 3.2Å
72	G	70.4	Confident	74	Confident	24 Å²	24	125.8 Å²	125.8	25%	0.247	62%	0.618	C	S	.	*	H	α-helix	trans	-70.2	-35.9	176.1	0	0	0	0	0	113.5	L68 E69 E70 K75 K76	L68-G72 PolarHBondContact O-N 2.9Å; E69-G72 CarbonylContact O-C 3.4Å; E69-G72 WeakPolarHBondContact O-CA 3.11Å; E69-G72 PolarHBondContact O-N 3.47Å; E70-G72 PolarHBondContact O-N 3.45Å; G72-K75 PolarHBondContact O-N 3.46Å; G72-K76 VanDerWaalsContact O-CB 3.32Å; G72-K76 WeakPolarHBondContact O-CB 3.3Å; G72-K76 WeakPolarHBondContact O-CG 3.38Å; G72-K76 PolarHBondContact O-N 3.1Å
73	R	67.4	Low	73.6	Confident	175 Å²	175	125.4 Å²	125.4	66%	0.66	61%	0.609	S	S	*	*	H	α-helix	trans	-64.4	-44.3	-177.3	-164.5	179.2	72.2	-161.4	-1.4	111.8	E69 E70 K75 K76 A77	E69-R73 PolarHBondContact O-N 2.91Å; E70-R73 PolarHBondContact O-N 3.23Å; R73-K75 PolarHBondContact O-N 3.3Å; R73-K76 PolarHBondContact O-N 3.14Å; R73-A77 WeakPolarHBondContact O-CB 3.28Å; R73-A77 PolarHBondContact O-N 3.46Å
74	A	64.9	Low	73.3	Confident	61 Å²	61	123.9 Å²	123.9	50%	0.504	61%	0.612	S	S	.	*	H	α-helix	trans	-64.1	-39.7	176.5	0	0	0	0	0	112.2	K78	A74-K78 PolarHBondContact O-N 3.14Å
75	K	64.7	Low	73.3	Confident	160 Å²	160	126.6 Å²	126.6	70%	0.696	62%	0.617	S	S	*	*	H	α-helix	trans	-69.1	-39.1	175.1	-69.1	-179.4	-179.2	178.9	0	112	G72 R73 K79	G72-K75 PolarHBondContact O-N 3.46Å; R73-K75 PolarHBondContact O-N 3.3Å; K75-K79 VanDerWaalsContact O-CB 3.28Å; K75-K79 WeakPolarHBondContact O-CB 3.31Å; K75-K79 PolarHBondContact O-N 2.84Å
76	K	60.5	Low	73.5	Confident	178 Å²	178	125.1 Å²	125.1	77%	0.774	61%	0.612	S	S	*	*	H	α-helix	trans	-65.7	-39.7	176.3	-81.8	178.3	179.3	176.3	0	112.2	G72 R73	G72-K76 VanDerWaalsContact O-CB 3.32Å; G72-K76 WeakPolarHBondContact O-CB 3.3Å; G72-K76 WeakPolarHBondContact O-CG 3.38Å; G72-K76 PolarHBondContact O-N 3.1Å; R73-K76 PolarHBondContact O-N 3.14Å
77	A	62.5	Low	73.7	Confident	75 Å²	75	123 Å²	123	62%	0.62	60%	0.602	S	S	*	*	H	α-helix	trans	-64	-40.8	178.1	0	0	0	0	0	112.4	R73	R73-A77 WeakPolarHBondContact O-CB 3.28Å; R73-A77 PolarHBondContact O-N 3.46Å
78	K	61.7	Low	74	Confident	186 Å²	186	119.6 Å²	119.6	81%	0.809	59%	0.593	S	S	*	*	H	α-helix	trans	-83.2	-31.6	-177	-65.2	-174.6	-178.6	-176.3	0	114.2	A74 G80	A74-K78 PolarHBondContact O-N 3.14Å; K78-G80 PolarHBondContact O-N 2.92Å; K78-G80 VanDerWaalsContact O-N 3.08Å
79	K	59.3	Low	74.5	Confident	198 Å²	198	119.9 Å²	119.9	86%	0.861	59%	0.589	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.6	8.2	-171.9	-168.7	143.3	-180	168	0	115.3	K75	K75-K79 VanDerWaalsContact O-CB 3.28Å; K75-K79 WeakPolarHBondContact O-CB 3.31Å; K75-K79 PolarHBondContact O-N 2.84Å
80	G	59.3	Low	75.2	Confident	33 Å²	33	117.2 Å²	117.2	34%	0.34	58%	0.579	S	S	.	*	T	Hydrogen-bonded Turn	trans	-171.1	57.9	-178.3	0	0	0	0	0	113.8	K78 L82 T83	K78-G80 PolarHBondContact O-N 2.92Å; K78-G80 VanDerWaalsContact O-N 3.08Å; G80-L82 CarbonylContact O-C 3.22Å; G80-L82 VanDerWaalsContact O-C 3.22Å; G80-L82 WeakPolarHBondContact O-CA 3.26Å; G80-L82 PolarHBondContact O-N 3.31Å; G80-T83 PolarHBondContact O-N 2.93Å
81	F	65.1	Low	75.9	Confident	201 Å²	201	118.5 Å²	118.5	88%	0.882	58%	0.579	S	S	*	*	S	Bend	trans	-42.7	-22.2	174.2	177.8	-107.5	0	0	0	113.8
82	L	71.1	Confident	76.7	Confident	63 Å²	63	120.8 Å²	120.8	33%	0.33	58%	0.58	S	S	.	*	S	Bend	trans	-134.6	116.7	156	-159.1	63	0	0	0	111.3	G80 R86 K87 L90	G80-L82 CarbonylContact O-C 3.22Å; G80-L82 VanDerWaalsContact O-C 3.22Å; G80-L82 WeakPolarHBondContact O-CA 3.26Å; G80-L82 PolarHBondContact O-N 3.31Å; L82-R86 HydrophobicContact CD1-CB 3.51Å; L82-R86 HydrophobicContact CD1-CG 4.34Å; L82-R86 HydrophobicContact CG-CB 3.89Å; L82-K87 HydrophobicContact CB-CG 4Å; L82-K87 HydrophobicContact CD2-CB 4.38Å; L82-K87 HydrophobicContact CD2-CG 3.42Å; L82-K87 VanDerWaalsContact CD2-CG 3.42Å; L82-K87 HydrophobicContact CG-CG 3.64Å; L82-K87 WeakPolarHBondContact O-CE 3.34Å; L82-L90 HydrophobicContact CD2-CD2 4.19Å
83	T	83.8	Confident	77.9	Confident	51 Å²	51	124 Å²	124	31%	0.313	59%	0.591	S	S	.	*			trans	-59	148.1	175.7	65	0	0	0	0	110.3	G80 E85 R86 K87	G80-T83 PolarHBondContact O-N 2.93Å; T83-E85 PolarHBondContact O-N 3.3Å; T83-E85 VanDerWaalsContact O-N 3.16Å; T83-R86 PolarHBondContact O-N 3.37Å; T83-R86 WeakPolarHBondContact OG1-CB 2.8Å; T83-R86 VanDerWaalsContact OG1-CG 3.23Å; T83-R86 WeakPolarHBondContact OG1-CG 3.48Å; T83-R86 PolarHBondContact OG1-N 2.89Å; T83-K87 PolarHBondContact O-N 3.24Å
84	P	84.6	Confident	79.3	Confident	112 Å²	112	120.6 Å²	120.6	73%	0.727	59%	0.586	S	S	*	*	H	α-helix	trans	-53.5	-34.8	177.9	-28.2	35.8	0	0	0	113.7	K87 K88	P84-K87 PolarHBondContact O-N 3.43Å; P84-K88 PolarHBondContact O-N 2.92Å
85	E	85.7	Confident	80.8	Confident	158 Å²	158	124.1 Å²	124.1	74%	0.738	59%	0.593	S	S	*	*	H	α-helix	trans	-64.5	-47.4	174.4	-69.9	164.3	-167.4	0	0	112.4	T83 K87 K88 K89	T83-E85 PolarHBondContact O-N 3.3Å; T83-E85 VanDerWaalsContact O-N 3.16Å; E85-K87 VanDerWaalsContact C-N 3.33Å; E85-K87 PolarHBondContact O-N 2.97Å; E85-K88 PolarHBondContact O-N 3.45Å; E85-K88 VanDerWaalsContact O-N 3.16Å; E85-K89 PolarHBondContact O-N 3.4Å
86	R	88.4	Confident	82.3	Confident	163 Å²	163	123.3 Å²	123.3	62%	0.615	59%	0.59	S	S	*	*	H	α-helix	trans	-62	-41.4	175.9	-73.4	175.2	-176.6	-168.1	0.7	111.2	L82 T83 K88 K89 L90	L82-R86 HydrophobicContact CD1-CB 3.51Å; L82-R86 HydrophobicContact CD1-CG 4.34Å; L82-R86 HydrophobicContact CG-CB 3.89Å; T83-R86 PolarHBondContact O-N 3.37Å; T83-R86 WeakPolarHBondContact OG1-CB 2.8Å; T83-R86 VanDerWaalsContact OG1-CG 3.23Å; T83-R86 WeakPolarHBondContact OG1-CG 3.48Å; T83-R86 PolarHBondContact OG1-N 2.89Å; R86-K88 VanDerWaalsContact C-N 3.33Å; R86-K88 PolarHBondContact O-N 3.28Å; R86-K89 PolarHBondContact O-N 2.89Å; R86-L90 VanDerWaalsContact O-CB 3.29Å; R86-L90 WeakPolarHBondContact O-CB 3.4Å; R86-L90 PolarHBondContact O-N 3.39Å
87	K	90.1	Very high	84	Confident	100 Å²	100	121 Å²	121	44%	0.435	58%	0.579	S	S	.	*	H	α-helix	trans	-59	-42.5	173.5	-74	-176.8	-177.1	-175.9	0	112.1	L82 T83 P84 E85 R91	L82-K87 HydrophobicContact CB-CG 4Å; L82-K87 HydrophobicContact CD2-CB 4.38Å; L82-K87 HydrophobicContact CD2-CG 3.42Å; L82-K87 VanDerWaalsContact CD2-CG 3.42Å; L82-K87 HydrophobicContact CG-CG 3.64Å; L82-K87 WeakPolarHBondContact O-CE 3.34Å; T83-K87 PolarHBondContact O-N 3.24Å; P84-K87 PolarHBondContact O-N 3.43Å; E85-K87 VanDerWaalsContact C-N 3.33Å; E85-K87 PolarHBondContact O-N 2.97Å; K87-R91 WeakPolarHBondContact O-CG 3.36Å; K87-R91 PolarHBondContact O-N 3.12Å
88	K	91.7	Very high	85.7	Confident	127 Å²	127	120.1 Å²	120.1	55%	0.552	57%	0.572	S	S	*	*	H	α-helix	trans	-65.5	-48	177.9	-174	-179.1	178.4	-176.3	0	111.1	P84 E85 R86 L90 R91 Q92	P84-K88 PolarHBondContact O-N 2.92Å; E85-K88 PolarHBondContact O-N 3.45Å; E85-K88 VanDerWaalsContact O-N 3.16Å; R86-K88 VanDerWaalsContact C-N 3.33Å; R86-K88 PolarHBondContact O-N 3.28Å; K88-L90 VanDerWaalsContact C-N 3.32Å; K88-L90 PolarHBondContact O-N 2.84Å; K88-R91 PolarHBondContact O-N 3.33Å; K88-Q92 WeakPolarHBondContact O-CG 3.31Å; K88-Q92 PolarHBondContact O-N 2.94Å
89	K	93.5	Very high	87.3	Confident	139 Å²	139	113.7 Å²	113.7	60%	0.604	55%	0.554	S	S	*	*	H	α-helix	trans	-59.4	-43.6	176.3	-173.5	173.6	-178.9	177.6	0	111.3	E85 R86 Q92 L93	E85-K89 PolarHBondContact O-N 3.4Å; R86-K89 PolarHBondContact O-N 2.89Å; K89-Q92 PolarHBondContact O-N 3.01Å; K89-L93 HydrophobicContact CG-CD1 4.34Å; K89-L93 WeakPolarHBondContact O-CG 3.45Å; K89-L93 PolarHBondContact O-N 3.01Å
90	L	94.8	Very high	89.1	Confident	87 Å²	87	109.6 Å²	109.6	46%	0.455	54%	0.538	S	S	.	.	H	α-helix	trans	-60.1	-50.4	177.3	-178.4	61.3	0	0	0	111.7	L82 R86 K88 Q92 L93 L94	L82-L90 HydrophobicContact CD2-CD2 4.19Å; R86-L90 VanDerWaalsContact O-CB 3.29Å; R86-L90 WeakPolarHBondContact O-CB 3.4Å; R86-L90 PolarHBondContact O-N 3.39Å; K88-L90 VanDerWaalsContact C-N 3.32Å; K88-L90 PolarHBondContact O-N 2.84Å; L90-Q92 VanDerWaalsContact C-N 3.28Å; L90-Q92 PolarHBondContact O-N 3.06Å; L90-L93 PolarHBondContact O-N 2.89Å; L90-L93 VanDerWaalsContact O-N 3.11Å; L90-L94 HydrophobicContact CD1-CD1 3.46Å; L90-L94 VanDerWaalsContact CD1-CD1 3.46Å; L90-L94 HydrophobicContact CG-CD1 3.86Å; L90-L94 WeakPolarHBondContact O-CD1 3.38Å; L90-L94 PolarHBondContact O-N 3.05Å
91	R	95.1	Very high	90.9	Very high	143 Å²	143	110.8 Å²	110.8	54%	0.54	54%	0.536	S	S	.	.	H	α-helix	trans	-57.2	-42.1	176.3	-74.4	-171.4	-65.7	-91.5	1.2	112.2	K87 K88 L94 M95	K87-R91 WeakPolarHBondContact O-CG 3.36Å; K87-R91 PolarHBondContact O-N 3.12Å; K88-R91 PolarHBondContact O-N 3.33Å; R91-L94 PolarHBondContact O-N 3.4Å; R91-M95 VanDerWaalsContact O-CG 3.25Å; R91-M95 WeakPolarHBondContact O-CG 3.23Å; R91-M95 PolarHBondContact O-N 2.87Å
92	Q	96	Very high	92.3	Very high	102 Å²	102	105.7 Å²	105.7	48%	0.477	52%	0.518	S	S	.	.	H	α-helix	trans	-62.8	-41.3	176.7	-72.9	175.5	-20.5	0	0	112.2	K88 K89 L90 M95 K96	K88-Q92 WeakPolarHBondContact O-CG 3.31Å; K88-Q92 PolarHBondContact O-N 2.94Å; K89-Q92 PolarHBondContact O-N 3.01Å; L90-Q92 VanDerWaalsContact C-N 3.28Å; L90-Q92 PolarHBondContact O-N 3.06Å; Q92-M95 PolarHBondContact O-N 3.14Å; Q92-K96 WeakPolarHBondContact O-CB 3.49Å; Q92-K96 VanDerWaalsContact O-CG 3.28Å; Q92-K96 WeakPolarHBondContact O-CG 3.38Å; Q92-K96 PolarHBondContact O-N 3.42Å
93	L	96.1	Very high	93.5	Very high	92 Å²	92	109.8 Å²	109.8	48%	0.482	53%	0.533	S	S	.	.	H	α-helix	trans	-65.1	-41.5	176	-69.8	173	0	0	0	111.9	K89 L90 M95 K96 K97	K89-L93 HydrophobicContact CG-CD1 4.34Å; K89-L93 WeakPolarHBondContact O-CG 3.45Å; K89-L93 PolarHBondContact O-N 3.01Å; L90-L93 PolarHBondContact O-N 2.89Å; L90-L93 VanDerWaalsContact O-N 3.11Å; L93-M95 PolarHBondContact O-N 3.33Å; L93-K96 PolarHBondContact O-N 3.45Å; L93-K97 WeakPolarHBondContact O-CB 3.32Å; L93-K97 PolarHBondContact O-N 3.44Å
94	L	96.8	Very high	94.2	Very high	104 Å²	104	111.9 Å²	111.9	55%	0.545	54%	0.539	S	S	.	.	H	α-helix	trans	-62.3	-43	176	-91.9	70.9	0	0	0	111.8	L90 R91 K97 A98	L90-L94 HydrophobicContact CD1-CD1 3.46Å; L90-L94 VanDerWaalsContact CD1-CD1 3.46Å; L90-L94 HydrophobicContact CG-CD1 3.86Å; L90-L94 WeakPolarHBondContact O-CD1 3.38Å; L90-L94 PolarHBondContact O-N 3.05Å; R91-L94 PolarHBondContact O-N 3.4Å; L94-K97 PolarHBondContact O-N 3.26Å; L94-A98 WeakPolarHBondContact O-CB 3.22Å; L94-A98 PolarHBondContact O-N 2.84Å
95	M	96.2	Very high	94.7	Very high	135 Å²	135	112.6 Å²	112.6	67%	0.665	53%	0.533	S	S	*	.	H	α-helix	trans	-67.5	-38.2	177.3	-64.2	-63.3	153.8	0	0	111.9	R91 Q92 L93 A98 A99	R91-M95 VanDerWaalsContact O-CG 3.25Å; R91-M95 WeakPolarHBondContact O-CG 3.23Å; R91-M95 PolarHBondContact O-N 2.87Å; Q92-M95 PolarHBondContact O-N 3.14Å; L93-M95 PolarHBondContact O-N 3.33Å; M95-A98 PolarHBondContact O-N 3.45Å; M95-A99 WeakPolarHBondContact O-CB 3.49Å; M95-A99 PolarHBondContact O-N 2.9Å
96	K	96.7	Very high	95.2	Very high	143 Å²	143	110.7 Å²	110.7	62%	0.622	52%	0.524	S	S	*	.	H	α-helix	trans	-63.3	-47.8	174.1	-76.8	179.3	178.4	-169.1	0	111.5	Q92 L93 A99 E100	Q92-K96 WeakPolarHBondContact O-CB 3.49Å; Q92-K96 VanDerWaalsContact O-CG 3.28Å; Q92-K96 WeakPolarHBondContact O-CG 3.38Å; Q92-K96 PolarHBondContact O-N 3.42Å; L93-K96 PolarHBondContact O-N 3.45Å; K96-A99 PolarHBondContact O-N 2.99Å; K96-E100 WeakPolarHBondContact O-CB 3.34Å; K96-E100 PolarHBondContact O-N 3.04Å
97	K	96	Very high	95.5	Very high	128 Å²	128	107.9 Å²	107.9	56%	0.557	52%	0.521	S	S	*	.	H	α-helix	trans	-60.2	-46.7	176	-176.7	177.8	177.1	177	0	111.1	L93 L94 A99 E100 D101	L93-K97 WeakPolarHBondContact O-CB 3.32Å; L93-K97 PolarHBondContact O-N 3.44Å; L94-K97 PolarHBondContact O-N 3.26Å; K97-A99 VanDerWaalsContact C-N 3.3Å; K97-A99 PolarHBondContact O-N 3.27Å; K97-E100 PolarHBondContact O-N 2.78Å; K97-E100 VanDerWaalsContact O-N 3.14Å; K97-D101 WeakPolarHBondContact CE-OD2 3.5Å; K97-D101 WeakPolarHBondContact O-CB 3.42Å; K97-D101 VanDerWaalsContact O-CG 3.22Å; K97-D101 PolarHBondContact O-N 3.14Å
98	A	97.1	Very high	95.8	Very high	57 Å²	57	108.2 Å²	108.2	47%	0.471	53%	0.527	S	S	.	.	H	α-helix	trans	-60.1	-39	177.8	0	0	0	0	0	112.7	L94 M95 L102	L94-A98 WeakPolarHBondContact O-CB 3.22Å; L94-A98 PolarHBondContact O-N 2.84Å; M95-A98 PolarHBondContact O-N 3.45Å; A98-L102 VanDerWaalsContact O-CB 3.3Å; A98-L102 WeakPolarHBondContact O-CB 3.3Å; A98-L102 PolarHBondContact O-N 3Å
99	A	96.4	Very high	96	Very high	51 Å²	51	110 Å²	110	42%	0.421	53%	0.534	S	S	.	.	H	α-helix	trans	-70.7	-35.2	175.6	0	0	0	0	0	112.8	M95 K96 K97 K103	M95-A99 WeakPolarHBondContact O-CB 3.49Å; M95-A99 PolarHBondContact O-N 2.9Å; K96-A99 PolarHBondContact O-N 2.99Å; K97-A99 VanDerWaalsContact C-N 3.3Å; K97-A99 PolarHBondContact O-N 3.27Å; A99-K103 WeakPolarHBondContact O-CG 3.5Å; A99-K103 PolarHBondContact O-N 3.49Å; A99-K103 VanDerWaalsContact O-N 3.12Å
100	E	97.2	Very high	96.1	Very high	112 Å²	112	107.4 Å²	107.4	52%	0.523	52%	0.524	S	S	.	.	H	α-helix	trans	-67.8	-50.1	174.2	-176.7	175.3	-174.6	0	0	111.3	K96 K97 L102 K103 Q104	K96-E100 WeakPolarHBondContact O-CB 3.34Å; K96-E100 PolarHBondContact O-N 3.04Å; K97-E100 PolarHBondContact O-N 2.78Å; K97-E100 VanDerWaalsContact O-N 3.14Å; E100-L102 VanDerWaalsContact C-N 3.27Å; E100-L102 PolarHBondContact O-N 2.87Å; E100-K103 WeakPolarHBondContact O-CB 3.27Å; E100-K103 PolarHBondContact O-N 2.96Å; E100-Q104 WeakPolarHBondContact O-CG 3.3Å; E100-Q104 PolarHBondContact O-N 3.27Å
101	D	96.7	Very high	96.2	Very high	58 Å²	58	108.4 Å²	108.4	31%	0.31	53%	0.527	S	S	.	.	H	α-helix	trans	-57.2	-41.3	176	-67.3	-8	0	0	0	110.4	K97 Q104 Q105	K97-D101 WeakPolarHBondContact CE-OD2 3.5Å; K97-D101 WeakPolarHBondContact O-CB 3.42Å; K97-D101 VanDerWaalsContact O-CG 3.22Å; K97-D101 PolarHBondContact O-N 3.14Å; D101-Q104 PolarHBondContact O-N 3.48Å; D101-Q105 WeakPolarHBondContact O-CB 3.41Å; D101-Q105 VanDerWaalsContact O-CG 3.27Å; D101-Q105 WeakPolarHBondContact O-CG 3.39Å; D101-Q105 PolarHBondContact O-N 3.33Å
102	L	95.2	Very high	96.2	Very high	94 Å²	94	105.5 Å²	105.5	49%	0.492	52%	0.519	S	S	.	.	H	α-helix	trans	-62.6	-43	175	-179.5	64	0	0	0	112.3	A98 E100 Q105 Q106	A98-L102 VanDerWaalsContact O-CB 3.3Å; A98-L102 WeakPolarHBondContact O-CB 3.3Å; A98-L102 PolarHBondContact O-N 3Å; E100-L102 VanDerWaalsContact C-N 3.27Å; E100-L102 PolarHBondContact O-N 2.87Å; L102-Q105 PolarHBondContact O-N 3Å; L102-Q106 VanDerWaalsContact O-CG 3.3Å; L102-Q106 WeakPolarHBondContact O-CG 3.45Å; L102-Q106 PolarHBondContact O-N 3.38Å
103	K	96.2	Very high	96.1	Very high	149 Å²	149	107 Å²	107	65%	0.648	52%	0.521	S	S	*	.	H	α-helix	trans	-66.7	-40.2	176.5	-76.6	179.5	178.9	-175	0	112.1	A99 E100 Q106 L107	A99-K103 WeakPolarHBondContact O-CG 3.5Å; A99-K103 PolarHBondContact O-N 3.49Å; A99-K103 VanDerWaalsContact O-N 3.12Å; E100-K103 WeakPolarHBondContact O-CB 3.27Å; E100-K103 PolarHBondContact O-N 2.96Å; K103-Q106 PolarHBondContact O-N 3.47Å; K103-L107 PolarHBondContact O-N 2.82Å
104	Q	96.9	Very high	95.9	Very high	95 Å²	95	106.2 Å²	106.2	44%	0.444	52%	0.515	S	S	.	.	H	α-helix	trans	-62.9	-44.5	175.4	-72.1	178.7	-2.8	0	0	110.8	E100 D101 Q106 L107 L108	E100-Q104 WeakPolarHBondContact O-CG 3.3Å; E100-Q104 PolarHBondContact O-N 3.27Å; D101-Q104 PolarHBondContact O-N 3.48Å; Q104-Q106 VanDerWaalsContact C-N 3.33Å; Q104-Q106 PolarHBondContact O-N 3.5Å; Q104-L107 PolarHBondContact O-N 2.99Å; Q104-L108 WeakPolarHBondContact O-CB 3.4Å; Q104-L108 VanDerWaalsContact O-CG 3.32Å; Q104-L108 WeakPolarHBondContact O-CG 3.39Å; Q104-L108 PolarHBondContact O-N 2.92Å
105	Q	96	Very high	95.7	Very high	128 Å²	128	107.8 Å²	107.8	60%	0.598	51%	0.513	S	S	*	.	H	α-helix	trans	-61.2	-40.2	174.4	-73.9	175.7	12.6	0	0	112.3	D101 L102 K109	D101-Q105 WeakPolarHBondContact O-CB 3.41Å; D101-Q105 VanDerWaalsContact O-CG 3.27Å; D101-Q105 WeakPolarHBondContact O-CG 3.39Å; D101-Q105 PolarHBondContact O-N 3.33Å; L102-Q105 PolarHBondContact O-N 3Å; Q105-K109 WeakPolarHBondContact O-CB 3.37Å; Q105-K109 PolarHBondContact O-N 2.95Å
106	Q	95.9	Very high	95.4	Very high	118 Å²	118	104.8 Å²	104.8	55%	0.551	50%	0.499	S	S	*	.	H	α-helix	trans	-62.5	-44.2	174.6	-75.1	173.6	-9.9	0	0	111.9	L102 K103 Q104 K109 E110	L102-Q106 VanDerWaalsContact O-CG 3.3Å; L102-Q106 WeakPolarHBondContact O-CG 3.45Å; L102-Q106 PolarHBondContact O-N 3.38Å; K103-Q106 PolarHBondContact O-N 3.47Å; Q104-Q106 VanDerWaalsContact C-N 3.33Å; Q104-Q106 PolarHBondContact O-N 3.5Å; Q106-K109 PolarHBondContact O-N 2.94Å; Q106-E110 PolarHBondContact O-N 3.44Å
107	L	95.8	Very high	95	Very high	104 Å²	104	101.1 Å²	101.1	55%	0.545	49%	0.486	S	S	.	.	H	α-helix	trans	-63.4	-46.9	177.5	-179.1	66.1	0	0	0	111.7	K103 Q104 K109 E110 Q111	K103-L107 PolarHBondContact O-N 2.82Å; Q104-L107 PolarHBondContact O-N 2.99Å; L107-K109 VanDerWaalsContact C-N 3.31Å; L107-K109 PolarHBondContact O-N 3.44Å; L107-E110 PolarHBondContact O-N 3.35Å; L107-Q111 WeakPolarHBondContact O-CG 3.3Å; L107-Q111 PolarHBondContact O-N 3.16Å
108	L	96.3	Very high	94.6	Very high	107 Å²	107	102 Å²	102	56%	0.56	49%	0.492	S	S	*	.	H	α-helix	trans	-61.7	-40.8	176.7	-69.9	174.6	0	0	0	111.4	Q104 Q111 E112	Q104-L108 WeakPolarHBondContact O-CB 3.4Å; Q104-L108 VanDerWaalsContact O-CG 3.32Å; Q104-L108 WeakPolarHBondContact O-CG 3.39Å; Q104-L108 PolarHBondContact O-N 2.92Å; L108-Q111 PolarHBondContact O-N 3.32Å; L108-E112 WeakPolarHBondContact O-CB 3.4Å; L108-E112 PolarHBondContact O-N 3.11Å
109	K	96.2	Very high	94.1	Very high	163 Å²	163	105.2 Å²	105.2	71%	0.709	50%	0.497	S	S	*	.	H	α-helix	trans	-65	-38.8	176.1	-172.8	178.4	-178.9	-179.3	0	111.9	Q105 Q106 L107 R113	Q105-K109 WeakPolarHBondContact O-CB 3.37Å; Q105-K109 PolarHBondContact O-N 2.95Å; Q106-K109 PolarHBondContact O-N 2.94Å; L107-K109 VanDerWaalsContact C-N 3.31Å; L107-K109 PolarHBondContact O-N 3.44Å; K109-R113 VanDerWaalsContact O-CB 3.23Å; K109-R113 WeakPolarHBondContact O-CB 3.23Å; K109-R113 PolarHBondContact O-N 3.32Å
110	E	95.4	Very high	93.4	Very high	85 Å²	85	109.1 Å²	109.1	40%	0.397	50%	0.501	S	S	.	.	H	α-helix	trans	-68.6	-42.6	174.8	-172.5	59.5	-132.4	0	0	111.2	Q106 L107 E112 R113 Q114	Q106-E110 PolarHBondContact O-N 3.44Å; L107-E110 PolarHBondContact O-N 3.35Å; E110-E112 PolarHBondContact O-N 2.7Å; E110-R113 WeakPolarHBondContact O-CB 3.42Å; E110-R113 PolarHBondContact O-N 2.92Å; E110-R113 IonicContact OE1-NH1 3.87Å; E110-R113 PolarHBondContact OE1-NH1 2.96Å; E110-Q114 VanDerWaalsContact O-CG 3.3Å; E110-Q114 WeakPolarHBondContact O-CG 3.37Å; E110-Q114 PolarHBondContact O-N 2.85Å; E110-Q114 PolarHBondContact OE1-NE2 3.04Å
111	Q	95.8	Very high	92.7	Very high	108 Å²	108	108.4 Å²	108.4	51%	0.505	50%	0.5	S	S	.	.	H	α-helix	trans	-59.9	-46	175.3	-73.9	174.1	-9.8	0	0	111.8	L107 L108 R113 Q114 R115	L107-Q111 WeakPolarHBondContact O-CG 3.3Å; L107-Q111 PolarHBondContact O-N 3.16Å; L108-Q111 PolarHBondContact O-N 3.32Å; Q111-R113 VanDerWaalsContact C-N 3.32Å; Q111-R113 PolarHBondContact O-N 2.86Å; Q111-Q114 PolarHBondContact O-N 3.45Å; Q111-R115 WeakPolarHBondContact O-CB 3.33Å; Q111-R115 PolarHBondContact O-N 3.35Å
112	E	94.7	Very high	91.7	Very high	83 Å²	83	109.1 Å²	109.1	39%	0.388	50%	0.503	S	S	.	.	H	α-helix	trans	-65.4	-37.7	176.4	-172.9	59.3	-158.6	0	0	111.4	L108 E110 R115 I116	L108-E112 WeakPolarHBondContact O-CB 3.4Å; L108-E112 PolarHBondContact O-N 3.11Å; E110-E112 PolarHBondContact O-N 2.7Å; E112-R115 PolarHBondContact O-N 3.43Å; E112-I116 HydrophobicContact CG-CD1 3.9Å; E112-I116 HydrophobicContact CG-CG1 4.45Å; E112-I116 WeakPolarHBondContact O-CB 3.43Å; E112-I116 VanDerWaalsContact O-CG1 3.25Å; E112-I116 WeakPolarHBondContact O-CG1 3.41Å; E112-I116 PolarHBondContact O-N 3.04Å
113	R	93.9	Very high	91	Very high	133 Å²	133	110 Å²	110	50%	0.502	52%	0.515	S	S	.	.	H	α-helix	trans	-60.1	-45.8	172.7	178	-174.8	172.6	-78.2	-12.7	111.4	K109 E110 Q111 I116 L117	K109-R113 VanDerWaalsContact O-CB 3.23Å; K109-R113 WeakPolarHBondContact O-CB 3.23Å; K109-R113 PolarHBondContact O-N 3.32Å; E110-R113 WeakPolarHBondContact O-CB 3.42Å; E110-R113 PolarHBondContact O-N 2.92Å; E110-R113 IonicContact OE1-NH1 3.87Å; E110-R113 PolarHBondContact OE1-NH1 2.96Å; Q111-R113 VanDerWaalsContact C-N 3.32Å; Q111-R113 PolarHBondContact O-N 2.86Å; R113-I116 PolarHBondContact O-N 3.15Å; R113-L117 VanDerWaalsContact O-CB 3.28Å; R113-L117 WeakPolarHBondContact O-CB 3.43Å; R113-L117 PolarHBondContact O-N 2.85Å
114	Q	92.5	Very high	90.2	Very high	76 Å²	76	109.9 Å²	109.9	36%	0.355	52%	0.52	S	S	.	.	H	α-helix	trans	-64.1	-44.6	178.2	-66.5	-62.1	-27.4	0	0	111	E110 Q111 I116 L117 E118	E110-Q114 VanDerWaalsContact O-CG 3.3Å; E110-Q114 WeakPolarHBondContact O-CG 3.37Å; E110-Q114 PolarHBondContact O-N 2.85Å; E110-Q114 PolarHBondContact OE1-NE2 3.04Å; Q111-Q114 PolarHBondContact O-N 3.45Å; Q114-I116 PolarHBondContact O-N 3.42Å; Q114-L117 WeakPolarHBondContact O-CB 3.5Å; Q114-L117 PolarHBondContact O-N 3.27Å; Q114-L117 VanDerWaalsContact O-N 3.13Å; Q114-E118 WeakPolarHBondContact O-CG 3.29Å; Q114-E118 PolarHBondContact O-N 2.85Å
115	R	92.8	Very high	89.3	Confident	137 Å²	137	107.4 Å²	107.4	52%	0.517	51%	0.513	S	S	.	.	H	α-helix	trans	-57.8	-50.1	175.1	-178.2	-171.2	170.2	-179.5	1.4	112.3	Q111 E112 L117 E118 E119	Q111-R115 WeakPolarHBondContact O-CB 3.33Å; Q111-R115 PolarHBondContact O-N 3.35Å; E112-R115 PolarHBondContact O-N 3.43Å; R115-L117 PolarHBondContact O-N 3.32Å; R115-E118 PolarHBondContact O-N 2.92Å; R115-E119 IonicContact CZ-OE1 3.54Å; R115-E119 IonicContact NE-OE1 3.65Å; R115-E119 PolarHBondContact NE-OE1 3.46Å; R115-E119 IonicContact NH2-OE1 4Å; R115-E119 PolarHBondContact NH2-OE1 3.25Å; R115-E119 WeakPolarHBondContact O-CG 3.43Å; R115-E119 PolarHBondContact O-N 3.41Å
116	I	89.8	Confident	88.4	Confident	71 Å²	71	107.5 Å²	107.5	36%	0.364	52%	0.517	S	S	.	.	H	α-helix	trans	-61.8	-36.8	177.7	-69.1	167.6	0	0	0	110.4	E112 R113 Q114 E119 R120	E112-I116 HydrophobicContact CG-CD1 3.9Å; E112-I116 HydrophobicContact CG-CG1 4.45Å; E112-I116 WeakPolarHBondContact O-CB 3.43Å; E112-I116 VanDerWaalsContact O-CG1 3.25Å; E112-I116 WeakPolarHBondContact O-CG1 3.41Å; E112-I116 PolarHBondContact O-N 3.04Å; R113-I116 PolarHBondContact O-N 3.15Å; Q114-I116 PolarHBondContact O-N 3.42Å; I116-E119 PolarHBondContact O-N 2.93Å; I116-R120 HydrophobicContact CG2-CG 4.06Å; I116-R120 VanDerWaalsContact O-CB 3.26Å; I116-R120 WeakPolarHBondContact O-CB 3.27Å; I116-R120 WeakPolarHBondContact O-CG 3.28Å; I116-R120 PolarHBondContact O-N 3.04Å
117	L	87.8	Confident	87.5	Confident	66 Å²	66	105.4 Å²	105.4	35%	0.346	51%	0.512	S	S	.	.	H	α-helix	trans	-65.5	-45.2	177.7	-169.7	63.1	0	0	0	111.5	R113 Q114 R115 R120 I121	R113-L117 VanDerWaalsContact O-CB 3.28Å; R113-L117 WeakPolarHBondContact O-CB 3.43Å; R113-L117 PolarHBondContact O-N 2.85Å; Q114-L117 WeakPolarHBondContact O-CB 3.5Å; Q114-L117 PolarHBondContact O-N 3.27Å; Q114-L117 VanDerWaalsContact O-N 3.13Å; R115-L117 PolarHBondContact O-N 3.32Å; L117-R120 PolarHBondContact O-N 3.29Å; L117-I121 HydrophobicContact CD1-CD1 3.5Å; L117-I121 HydrophobicContact CD1-CG1 3.99Å; L117-I121 HydrophobicContact CD2-CD1 4.36Å; L117-I121 HydrophobicContact CG-CD1 3.59Å; L117-I121 HydrophobicContact CG-CG1 4.31Å; L117-I121 WeakPolarHBondContact O-CB 3.38Å; L117-I121 VanDerWaalsContact O-CG1 3.25Å; L117-I121 WeakPolarHBondContact O-CG1 3.45Å; L117-I121 PolarHBondContact O-N 3.04Å
118	E	87.4	Confident	86.8	Confident	146 Å²	146	107.8 Å²	107.8	68%	0.682	53%	0.526	S	S	*	.	H	α-helix	trans	-62.5	-38.6	174.7	-71	171.5	-172.4	0	0	112.3	Q114 R115	Q114-E118 WeakPolarHBondContact O-CG 3.29Å; Q114-E118 PolarHBondContact O-N 2.85Å; R115-E118 PolarHBondContact O-N 2.92Å
119	E	86.8	Confident	86	Confident	126 Å²	126	107.8 Å²	107.8	59%	0.589	53%	0.53	S	S	*	.	H	α-helix	trans	-71.2	-31.7	176.4	-71.9	176.3	-171.5	0	0	112.6	R115 I116	R115-E119 IonicContact CZ-OE1 3.54Å; R115-E119 IonicContact NE-OE1 3.65Å; R115-E119 PolarHBondContact NE-OE1 3.46Å; R115-E119 IonicContact NH2-OE1 4Å; R115-E119 PolarHBondContact NH2-OE1 3.25Å; R115-E119 WeakPolarHBondContact O-CG 3.43Å; R115-E119 PolarHBondContact O-N 3.41Å; I116-E119 PolarHBondContact O-N 2.93Å
120	R	82.3	Confident	85.2	Confident	132 Å²	132	102 Å²	102	50%	0.498	51%	0.506	S	S	.	.	H	α-helix	trans	-86.5	-33.2	-176.7	-72.3	-68.8	-177.5	97.8	-0.2	113.5	I116 L117	I116-R120 HydrophobicContact CG2-CG 4.06Å; I116-R120 VanDerWaalsContact O-CB 3.26Å; I116-R120 WeakPolarHBondContact O-CB 3.27Å; I116-R120 WeakPolarHBondContact O-CG 3.28Å; I116-R120 PolarHBondContact O-N 3.04Å; L117-R120 PolarHBondContact O-N 3.29Å
121	I	82.7	Confident	84.4	Confident	98 Å²	98	105.1 Å²	105.1	50%	0.503	53%	0.526	S	S	.	.	S	Bend	trans	-82.7	121.6	179.1	-63.4	176.7	0	0	0	108.2	L117	L117-I121 HydrophobicContact CD1-CD1 3.5Å; L117-I121 HydrophobicContact CD1-CG1 3.99Å; L117-I121 HydrophobicContact CD2-CD1 4.36Å; L117-I121 HydrophobicContact CG-CD1 3.59Å; L117-I121 HydrophobicContact CG-CG1 4.31Å; L117-I121 WeakPolarHBondContact O-CB 3.38Å; L117-I121 VanDerWaalsContact O-CG1 3.25Å; L117-I121 WeakPolarHBondContact O-CG1 3.45Å; L117-I121 PolarHBondContact O-N 3.04Å
122	L	75.6	Confident	83.9	Confident	72 Å²	72	104.2 Å²	104.2	38%	0.377	53%	0.525	S	S	.	.	P	Polyproline II helix	trans	-64.1	130.5	170.3	-63.5	173.2	0	0	0	108.6	L124 F143 K146	L122-L124 PolarHBondContact O-N 3.44Å; L122-F143 HydrophobicContact CB-CE1 4.08Å; L122-F143 HydrophobicContact CB-CZ 4.4Å; L122-F143 HydrophobicContact CD1-CD1 4.46Å; L122-F143 HydrophobicContact CD1-CE1 4.31Å; L122-K146 HydrophobicContact CD1-CB 4.29Å; L122-K146 HydrophobicContact CD1-CG 4.13Å
123	P	80.3	Confident	83.4	Confident	113 Å²	113	107.1 Å²	107.1	73%	0.734	54%	0.538	S	S	*	.	P	Polyproline II helix	trans	-57.5	133.2	174	24.3	-32.5	0	0	0	108.9	P125	P123-P125 VanDerWaalsContact O-CD 3.29Å; P123-P125 WeakPolarHBondContact O-CD 3.37Å; P123-P125 VanDerWaalsContact O-N 3.15Å
124	L	79.4	Confident	83.2	Confident	146 Å²	146	104.1 Å²	104.1	76%	0.764	54%	0.537	S	S	*	.	P	Polyproline II helix	trans	-61.6	118.5	-179	-65.3	175.4	0	0	0	108.9	L122 F143	L122-L124 PolarHBondContact O-N 3.44Å; L124-F143 HydrophobicContact CD2-CZ 4.47Å
125	P	78.1	Confident	83	Confident	44 Å²	44	104.7 Å²	104.7	29%	0.286	54%	0.54	S	S	.	.	P	Polyproline II helix	trans	-66.6	146.1	176.7	24.9	-29.8	0	0	0	109.7	P123 V127 I139 F143	P123-P125 VanDerWaalsContact O-CD 3.29Å; P123-P125 WeakPolarHBondContact O-CD 3.37Å; P123-P125 VanDerWaalsContact O-N 3.15Å; P125-V127 HydrophobicContact CG-CG1 4.5Å; P125-V127 PolarHBondContact O-N 3.16Å; P125-I139 HydrophobicContact CB-CD1 4.39Å; P125-I139 HydrophobicContact CG-CD1 4.43Å; P125-I139 HydrophobicContact CG-CG2 3.67Å; P125-F143 HydrophobicContact CG-CE2 3.81Å; P125-F143 HydrophobicContact CG-CZ 4.26Å
126	N	77.9	Confident	82.7	Confident	129 Å²	129	102 Å²	102	69%	0.69	54%	0.536	S	S	*	.			trans	-72.7	81.5	174.6	-70.2	-34.7	0	0	0	109.8	D128 T129	N126-D128 PolarHBondContact O-N 3Å; N126-T129 PolarHBondContact O-N 2.97Å
127	V	76.9	Confident	82.7	Confident	74 Å²	74	103.6 Å²	103.6	45%	0.448	54%	0.542	S	S	.	.	G	3₁₀ helix	trans	-57.1	-32.8	-176.9	-66.8	0	0	0	0	112.9	P125 T129 I130 L136	P125-V127 HydrophobicContact CG-CG1 4.5Å; P125-V127 PolarHBondContact O-N 3.16Å; V127-T129 PolarHBondContact O-N 3.45Å; V127-I130 PolarHBondContact O-N 3.38Å; V127-I130 VanDerWaalsContact O-N 3.12Å; V127-L136 HydrophobicContact CG1-CD1 4.34Å
128	D	79.3	Confident	82.9	Confident	155 Å²	155	106.6 Å²	106.6	83%	0.829	55%	0.552	S	S	*	*	G	3₁₀ helix	trans	-66.9	-20.8	-178	-62.8	-25.3	0	0	0	113.6	N126	N126-D128 PolarHBondContact O-N 3Å
129	T	81.1	Confident	82.9	Confident	107 Å²	107	101.2 Å²	101.2	66%	0.656	53%	0.528	S	S	*	.	G	3₁₀ helix	trans	-89.5	-13.3	178.9	-42	0	0	0	0	112	N126 V127 N131	N126-T129 PolarHBondContact O-N 2.97Å; V127-T129 PolarHBondContact O-N 3.45Å; T129-N131 PolarHBondContact O-N 3.48Å
130	I	79.1	Confident	82.9	Confident	40 Å²	40	98 Å²	98	21%	0.205	52%	0.522	C	S	.	.			trans	-91.7	99.3	-172.8	-57.4	173.6	0	0	0	109	V127 N132 E135 I139	V127-I130 PolarHBondContact O-N 3.38Å; V127-I130 VanDerWaalsContact O-N 3.12Å; I130-N132 VanDerWaalsContact C-N 3.34Å; I130-E135 HydrophobicContact CG2-CB 3.88Å; I130-I139 HydrophobicContact CD1-CD1 3.44Å; I130-I139 VanDerWaalsContact CD1-CD1 3.44Å
131	N	78.8	Confident	83.4	Confident	151 Å²	151	95.3 Å²	95.3	81%	0.807	52%	0.524	S	S	*	.			trans	-83.8	-10.1	177.9	-64	-37.1	0	0	0	113.4	T129	T129-N131 PolarHBondContact O-N 3.48Å
132	N	84.4	Confident	83.8	Confident	89 Å²	89	96.6 Å²	96.6	48%	0.476	53%	0.528	S	S	.	.			trans	-90.9	112.6	-175.5	-69.3	-18.7	0	0	0	111.1	I130 S134 E135 L136	I130-N132 VanDerWaalsContact C-N 3.34Å; N132-S134 VanDerWaalsContact C-N 3.31Å; N132-S134 PolarHBondContact O-N 3.35Å; N132-E135 HydrophobicContact CB-CB 4.13Å; N132-E135 HydrophobicContact CB-CG 3.95Å; N132-E135 PolarHBondContact ND2-OE1 3Å; N132-E135 PolarHBondContact O-N 3.32Å; N132-E135 VanDerWaalsContact O-N 3.15Å; N132-L136 PolarHBondContact O-N 2.93Å
133	Q	85.7	Confident	84.4	Confident	145 Å²	145	96 Å²	96	68%	0.678	52%	0.522	S	S	*	.	H	α-helix	trans	-56.9	-41	179.7	-177.6	-179.4	-17.3	0	0	113.2	E135 L136 E137	Q133-E135 VanDerWaalsContact C-N 3.3Å; Q133-E135 PolarHBondContact O-N 3.36Å; Q133-L136 WeakPolarHBondContact O-CB 3.19Å; Q133-L136 PolarHBondContact O-N 3.36Å; Q133-E137 PolarHBondContact NE2-OE1 3.41Å; Q133-E137 WeakPolarHBondContact O-CG 3.4Å; Q133-E137 PolarHBondContact O-N 3.16Å
134	S	89.4	Confident	85	Confident	69 Å²	69	96.1 Å²	96.1	48%	0.483	52%	0.516	S	S	.	.	H	α-helix	trans	-64.9	-33	-179.8	-177.4	0	0	0	0	113	N132 K138	N132-S134 VanDerWaalsContact C-N 3.31Å; N132-S134 PolarHBondContact O-N 3.35Å; S134-K138 VanDerWaalsContact O-CG 3.29Å; S134-K138 WeakPolarHBondContact O-CG 3.33Å; S134-K138 PolarHBondContact O-N 2.9Å
135	E	87.6	Confident	85.7	Confident	88 Å²	88	95.8 Å²	95.8	41%	0.411	51%	0.508	S	S	.	.	H	α-helix	trans	-69.9	-40.4	175.2	-70.4	172.6	-159.6	0	0	110.7	I130 N132 Q133 K138 I139	I130-E135 HydrophobicContact CG2-CB 3.88Å; N132-E135 HydrophobicContact CB-CB 4.13Å; N132-E135 HydrophobicContact CB-CG 3.95Å; N132-E135 PolarHBondContact ND2-OE1 3Å; N132-E135 PolarHBondContact O-N 3.32Å; N132-E135 VanDerWaalsContact O-N 3.15Å; Q133-E135 VanDerWaalsContact C-N 3.3Å; Q133-E135 PolarHBondContact O-N 3.36Å; E135-K138 PolarHBondContact O-N 3.17Å; E135-I139 VanDerWaalsContact O-CG1 3.31Å; E135-I139 WeakPolarHBondContact O-CG1 3.41Å; E135-I139 PolarHBondContact O-N 2.98Å
136	L	87.4	Confident	86.3	Confident	81 Å²	81	96.4 Å²	96.4	42%	0.424	51%	0.506	S	S	.	.	H	α-helix	trans	-63	-42.5	176.6	-172.9	61.3	0	0	0	112.2	V127 N132 Q133 K138 I139 A140	V127-L136 HydrophobicContact CG1-CD1 4.34Å; N132-L136 PolarHBondContact O-N 2.93Å; Q133-L136 WeakPolarHBondContact O-CB 3.19Å; Q133-L136 PolarHBondContact O-N 3.36Å; L136-K138 VanDerWaalsContact C-N 3.35Å; L136-K138 PolarHBondContact O-N 2.76Å; L136-I139 PolarHBondContact O-N 3.48Å; L136-A140 WeakPolarHBondContact O-CB 3.29Å; L136-A140 PolarHBondContact O-N 3.37Å
137	E	89.9	Confident	87	Confident	104 Å²	104	94.1 Å²	94.1	49%	0.486	49%	0.493	S	S	.	.	H	α-helix	trans	-63	-38.5	175.7	-73.3	173.3	-171.9	0	0	112.6	Q133 S141	Q133-E137 PolarHBondContact NE2-OE1 3.41Å; Q133-E137 WeakPolarHBondContact O-CG 3.4Å; Q133-E137 PolarHBondContact O-N 3.16Å; E137-S141 WeakPolarHBondContact O-CB 3.25Å; E137-S141 PolarHBondContact O-N 3.11Å; E137-S141 PolarHBondContact O-OG 3.06Å
138	K	90.1	Very high	87.9	Confident	130 Å²	130	93.4 Å²	93.4	57%	0.565	49%	0.492	S	S	*	.	H	α-helix	trans	-64.4	-48.7	174.3	-72.3	171.7	-171.9	177.7	0	111.6	S134 E135 L136 A140 S141 E142	S134-K138 VanDerWaalsContact O-CG 3.29Å; S134-K138 WeakPolarHBondContact O-CG 3.33Å; S134-K138 PolarHBondContact O-N 2.9Å; E135-K138 PolarHBondContact O-N 3.17Å; L136-K138 VanDerWaalsContact C-N 3.35Å; L136-K138 PolarHBondContact O-N 2.76Å; K138-A140 VanDerWaalsContact C-N 3.31Å; K138-A140 PolarHBondContact O-N 2.91Å; K138-S141 WeakPolarHBondContact O-CB 3.22Å; K138-S141 PolarHBondContact O-N 2.86Å; K138-S141 VanDerWaalsContact O-N 3.15Å; K138-E142 WeakPolarHBondContact O-CG 3.35Å; K138-E142 PolarHBondContact O-N 3.19Å
139	I	87.5	Confident	88.6	Confident	33 Å²	33	89.6 Å²	89.6	17%	0.169	47%	0.469	C	S	.	.	H	α-helix	trans	-57.4	-46.6	177	-70.9	167.1	0	0	0	110.3	P125 I130 E135 L136 S141 E142 F143	P125-I139 HydrophobicContact CB-CD1 4.39Å; P125-I139 HydrophobicContact CG-CD1 4.43Å; P125-I139 HydrophobicContact CG-CG2 3.67Å; I130-I139 HydrophobicContact CD1-CD1 3.44Å; I130-I139 VanDerWaalsContact CD1-CD1 3.44Å; E135-I139 VanDerWaalsContact O-CG1 3.31Å; E135-I139 WeakPolarHBondContact O-CG1 3.41Å; E135-I139 PolarHBondContact O-N 2.98Å; L136-I139 PolarHBondContact O-N 3.48Å; I139-S141 VanDerWaalsContact C-N 3.32Å; I139-S141 PolarHBondContact O-N 3.11Å; I139-E142 PolarHBondContact O-N 3.08Å; I139-F143 HydrophobicContact CG2-CD2 3.69Å; I139-F143 HydrophobicContact CG2-CE2 3.6Å; I139-F143 VanDerWaalsContact O-CD2 3.27Å; I139-F143 WeakPolarHBondContact O-CD2 3.46Å; I139-F143 PolarHBondContact O-N 2.91Å
140	A	88.2	Confident	89.1	Confident	58 Å²	58	87.7 Å²	87.7	48%	0.479	46%	0.455	S	S	.	.	H	α-helix	trans	-60.5	-41.3	177.8	0	0	0	0	0	112.2	L136 K138 F143 L144	L136-A140 WeakPolarHBondContact O-CB 3.29Å; L136-A140 PolarHBondContact O-N 3.37Å; K138-A140 VanDerWaalsContact C-N 3.31Å; K138-A140 PolarHBondContact O-N 2.91Å; A140-F143 PolarHBondContact O-N 3.04Å; A140-L144 WeakPolarHBondContact O-CB 3.16Å; A140-L144 PolarHBondContact O-N 3.01Å
141	S	92.3	Very high	89.8	Confident	75 Å²	75	91.5 Å²	91.5	52%	0.524	47%	0.471	S	S	.	.	H	α-helix	trans	-65.9	-39.4	177.2	-58	0	0	0	0	112.5	E137 K138 I139 L144 K145	E137-S141 WeakPolarHBondContact O-CB 3.25Å; E137-S141 PolarHBondContact O-N 3.11Å; E137-S141 PolarHBondContact O-OG 3.06Å; K138-S141 WeakPolarHBondContact O-CB 3.22Å; K138-S141 PolarHBondContact O-N 2.86Å; K138-S141 VanDerWaalsContact O-N 3.15Å; I139-S141 VanDerWaalsContact C-N 3.32Å; I139-S141 PolarHBondContact O-N 3.11Å; S141-L144 PolarHBondContact O-N 3.22Å; S141-K145 WeakPolarHBondContact O-CB 3.31Å; S141-K145 PolarHBondContact O-N 3.32Å
142	E	90.6	Very high	90.7	Very high	126 Å²	126	90.6 Å²	90.6	59%	0.589	46%	0.462	S	S	*	.	H	α-helix	trans	-64.5	-45.1	175.3	-74.5	177.8	-171.5	0	0	111.9	K138 I139 K145 K146	K138-E142 WeakPolarHBondContact O-CG 3.35Å; K138-E142 PolarHBondContact O-N 3.19Å; I139-E142 PolarHBondContact O-N 3.08Å; E142-K145 PolarHBondContact O-N 3.03Å; E142-K146 WeakPolarHBondContact O-CB 3.25Å; E142-K146 PolarHBondContact O-N 2.91Å
143	F	89.4	Confident	91.1	Very high	59 Å²	59	90.6 Å²	90.6	26%	0.259	46%	0.462	S	S	.	.	H	α-helix	trans	-61.5	-44.9	174.7	-85.7	-68.5	0	0	0	112	L122 L124 P125 I139 A140 K145 K146 I147	L122-F143 HydrophobicContact CB-CE1 4.08Å; L122-F143 HydrophobicContact CB-CZ 4.4Å; L122-F143 HydrophobicContact CD1-CD1 4.46Å; L122-F143 HydrophobicContact CD1-CE1 4.31Å; L124-F143 HydrophobicContact CD2-CZ 4.47Å; P125-F143 HydrophobicContact CG-CE2 3.81Å; P125-F143 HydrophobicContact CG-CZ 4.26Å; I139-F143 HydrophobicContact CG2-CD2 3.69Å; I139-F143 HydrophobicContact CG2-CE2 3.6Å; I139-F143 VanDerWaalsContact O-CD2 3.27Å; I139-F143 WeakPolarHBondContact O-CD2 3.46Å; I139-F143 PolarHBondContact O-N 2.91Å; A140-F143 PolarHBondContact O-N 3.04Å; F143-K145 PolarHBondContact O-N 3.15Å; F143-K146 PolarHBondContact O-N 3.28Å; F143-I147 WeakPolarHBondContact O-CB 3.44Å; F143-I147 WeakPolarHBondContact O-CD1 3.47Å; F143-I147 VanDerWaalsContact O-CG1 3.22Å; F143-I147 WeakPolarHBondContact O-CG1 3.23Å; F143-I147 PolarHBondContact O-N 3.36Å
144	L	93.1	Very high	91.6	Very high	116 Å²	116	89.4 Å²	89.4	61%	0.607	45%	0.454	S	S	*	.	H	α-helix	trans	-59.1	-48.9	178	178.8	62.3	0	0	0	111	A140 S141 K146 I147 S148	A140-L144 WeakPolarHBondContact O-CB 3.16Å; A140-L144 PolarHBondContact O-N 3.01Å; S141-L144 PolarHBondContact O-N 3.22Å; L144-K146 VanDerWaalsContact C-N 3.31Å; L144-K146 PolarHBondContact O-N 2.93Å; L144-I147 PolarHBondContact O-N 2.8Å; L144-S148 PolarHBondContact O-N 3.34Å; L144-S148 PolarHBondContact O-OG 3.45Å
145	K	94.2	Very high	92	Very high	139 Å²	139	92.5 Å²	92.5	60%	0.604	46%	0.456	S	S	*	.	H	α-helix	trans	-58.4	-45.1	176.6	-174.5	-176.7	176.4	-170.8	0	111.3	S141 E142 F143 I147 S148 E149	S141-K145 WeakPolarHBondContact O-CB 3.31Å; S141-K145 PolarHBondContact O-N 3.32Å; E142-K145 PolarHBondContact O-N 3.03Å; F143-K145 PolarHBondContact O-N 3.15Å; K145-I147 VanDerWaalsContact C-N 3.34Å; K145-I147 PolarHBondContact O-N 3.19Å; K145-S148 PolarHBondContact O-N 3.31Å; K145-E149 VanDerWaalsContact CE-OE1 3.28Å; K145-E149 WeakPolarHBondContact CE-OE1 3.42Å; K145-E149 WeakPolarHBondContact O-CG 3.34Å; K145-E149 PolarHBondContact O-N 3.49Å
146	K	90.4	Very high	92.4	Very high	56 Å²	56	92.6 Å²	92.6	24%	0.243	46%	0.46	C	S	.	.	H	α-helix	trans	-63.9	-40	-179.8	-174.7	59.3	-179.6	172.5	0	112.3	L122 E142 F143 L144 E149 L150	L122-K146 HydrophobicContact CD1-CB 4.29Å; L122-K146 HydrophobicContact CD1-CG 4.13Å; E142-K146 WeakPolarHBondContact O-CB 3.25Å; E142-K146 PolarHBondContact O-N 2.91Å; F143-K146 PolarHBondContact O-N 3.28Å; L144-K146 VanDerWaalsContact C-N 3.31Å; L144-K146 PolarHBondContact O-N 2.93Å; K146-E149 IonicContact NZ-OE2 2.68Å; K146-E149 PolarHBondContact O-N 3.45Å; K146-L150 HydrophobicContact CG-CD1 4.27Å; K146-L150 VanDerWaalsContact O-CG 3.3Å; K146-L150 WeakPolarHBondContact O-CG 3.46Å; K146-L150 PolarHBondContact O-N 3.26Å
147	I	92.3	Very high	92.8	Very high	81 Å²	81	94.5 Å²	94.5	42%	0.415	47%	0.47	S	S	.	.	H	α-helix	trans	-62.4	-48.4	175.6	-70.8	163.9	0	0	0	109.8	F143 L144 K145 E149 L150 E151	F143-I147 WeakPolarHBondContact O-CB 3.44Å; F143-I147 WeakPolarHBondContact O-CD1 3.47Å; F143-I147 VanDerWaalsContact O-CG1 3.22Å; F143-I147 WeakPolarHBondContact O-CG1 3.23Å; F143-I147 PolarHBondContact O-N 3.36Å; L144-I147 PolarHBondContact O-N 2.8Å; K145-I147 VanDerWaalsContact C-N 3.34Å; K145-I147 PolarHBondContact O-N 3.19Å; I147-E149 VanDerWaalsContact C-N 3.35Å; I147-E149 PolarHBondContact O-N 3.43Å; I147-L150 PolarHBondContact O-N 3.27Å; I147-L150 VanDerWaalsContact O-N 3.11Å; I147-E151 HydrophobicContact CG2-CG 4.2Å; I147-E151 WeakPolarHBondContact O-CB 3.41Å; I147-E151 WeakPolarHBondContact O-CG 3.26Å; I147-E151 PolarHBondContact O-N 2.9Å
148	S	95.4	Very high	93.2	Very high	59 Å²	59	94 Å²	94	41%	0.413	47%	0.467	S	S	.	.	H	α-helix	trans	-58.4	-43.8	178.3	-59.3	0	0	0	0	112.7	L144 K145 L150 E151 E152	L144-S148 PolarHBondContact O-N 3.34Å; L144-S148 PolarHBondContact O-OG 3.45Å; K145-S148 PolarHBondContact O-N 3.31Å; S148-L150 PolarHBondContact O-N 2.88Å; S148-E151 PolarHBondContact O-N 2.79Å; S148-E152 PolarHBondContact O-N 2.91Å
149	E	93.2	Very high	93.6	Very high	75 Å²	75	94 Å²	94	35%	0.35	47%	0.465	S	S	.	.	H	α-helix	trans	-61.2	-41.7	175	-70.9	172	-171.3	0	0	112.3	K145 K146 I147 L153	K145-E149 VanDerWaalsContact CE-OE1 3.28Å; K145-E149 WeakPolarHBondContact CE-OE1 3.42Å; K145-E149 WeakPolarHBondContact O-CG 3.34Å; K145-E149 PolarHBondContact O-N 3.49Å; K146-E149 IonicContact NZ-OE2 2.68Å; K146-E149 PolarHBondContact O-N 3.45Å; I147-E149 VanDerWaalsContact C-N 3.35Å; I147-E149 PolarHBondContact O-N 3.43Å; E149-L153 VanDerWaalsContact O-CG 3.31Å; E149-L153 WeakPolarHBondContact O-CG 3.26Å; E149-L153 PolarHBondContact O-N 3.41Å
150	L	91.8	Very high	94.1	Very high	68 Å²	68	94.3 Å²	94.3	36%	0.356	47%	0.47	S	S	.	.	H	α-helix	trans	-69.2	-36.3	178.2	-72.1	173	0	0	0	112.1	K146 I147 S148 K154	K146-L150 HydrophobicContact CG-CD1 4.27Å; K146-L150 VanDerWaalsContact O-CG 3.3Å; K146-L150 WeakPolarHBondContact O-CG 3.46Å; K146-L150 PolarHBondContact O-N 3.26Å; I147-L150 PolarHBondContact O-N 3.27Å; I147-L150 VanDerWaalsContact O-N 3.11Å; S148-L150 PolarHBondContact O-N 2.88Å; L150-K154 VanDerWaalsContact O-CB 3.26Å; L150-K154 WeakPolarHBondContact O-CB 3.41Å; L150-K154 PolarHBondContact O-N 3.34Å
151	E	94.9	Very high	94.6	Very high	119 Å²	119	95.3 Å²	95.3	56%	0.556	47%	0.47	S	S	*	.	H	α-helix	trans	-66.5	-42.6	176.4	-75.5	180	163.2	0	0	112.1	I147 S148 K154 Y155	I147-E151 HydrophobicContact CG2-CG 4.2Å; I147-E151 WeakPolarHBondContact O-CB 3.41Å; I147-E151 WeakPolarHBondContact O-CG 3.26Å; I147-E151 PolarHBondContact O-N 2.9Å; S148-E151 PolarHBondContact O-N 2.79Å; E151-K154 PolarHBondContact O-N 2.92Å; E151-Y155 WeakPolarHBondContact O-CB 3.35Å; E151-Y155 PolarHBondContact O-N 3.44Å
152	E	96.2	Very high	94.8	Very high	132 Å²	132	98.6 Å²	98.6	62%	0.617	47%	0.471	S	S	*	.	H	α-helix	trans	-58.9	-51.4	174.2	-176	178.8	178.5	0	0	111.1	S148 K154 Y155 D156	S148-E152 PolarHBondContact O-N 2.91Å; E152-K154 VanDerWaalsContact C-N 3.3Å; E152-K154 PolarHBondContact O-N 3.45Å; E152-Y155 WeakPolarHBondContact O-CB 3.32Å; E152-Y155 PolarHBondContact O-N 2.98Å; E152-Y155 VanDerWaalsContact O-N 3.14Å; E152-D156 PolarHBondContact O-N 2.8Å; E152-D156 VanDerWaalsContact O-N 3.1Å
153	L	94.1	Very high	95.2	Very high	90 Å²	90	98 Å²	98	47%	0.471	47%	0.468	S	S	.	.	H	α-helix	trans	-61	-38.8	177.7	-70.4	172	0	0	0	112.6	E149 L157	E149-L153 VanDerWaalsContact O-CG 3.31Å; E149-L153 WeakPolarHBondContact O-CG 3.26Å; E149-L153 PolarHBondContact O-N 3.41Å; L153-L157 VanDerWaalsContact O-CG 3.31Å; L153-L157 WeakPolarHBondContact O-CG 3.47Å; L153-L157 PolarHBondContact O-N 2.86Å; L153-L157 VanDerWaalsContact O-N 3.14Å
154	K	95.5	Very high	95.6	Very high	119 Å²	119	100.8 Å²	100.8	52%	0.517	48%	0.48	S	S	.	.	H	α-helix	trans	-62.4	-46.3	175.7	175.6	-170.2	165.6	-169.5	0	110.5	L150 E151 E152 D156 L157 E158	L150-K154 VanDerWaalsContact O-CB 3.26Å; L150-K154 WeakPolarHBondContact O-CB 3.41Å; L150-K154 PolarHBondContact O-N 3.34Å; E151-K154 PolarHBondContact O-N 2.92Å; E152-K154 VanDerWaalsContact C-N 3.3Å; E152-K154 PolarHBondContact O-N 3.45Å; K154-D156 PolarHBondContact O-N 3.22Å; K154-L157 PolarHBondContact O-N 3.1Å; K154-E158 WeakPolarHBondContact CE-OE1 3.42Å; K154-E158 HydrophobicContact CG-CG 4.37Å; K154-E158 IonicContact NZ-OE1 3.57Å; K154-E158 WeakPolarHBondContact O-CB 3.18Å; K154-E158 WeakPolarHBondContact O-CG 3.37Å; K154-E158 PolarHBondContact O-N 2.82Å
155	Y	97.5	Very high	95.8	Very high	134 Å²	134	99.7 Å²	99.7	53%	0.525	48%	0.475	S	S	.	.	H	α-helix	trans	-58.8	-46.5	-179.8	179.9	-92.1	0	0	0	111.7	E151 E152 L157 E158 Y159	E151-Y155 WeakPolarHBondContact O-CB 3.35Å; E151-Y155 PolarHBondContact O-N 3.44Å; E152-Y155 WeakPolarHBondContact O-CB 3.32Å; E152-Y155 PolarHBondContact O-N 2.98Å; E152-Y155 VanDerWaalsContact O-N 3.14Å; Y155-L157 PolarHBondContact O-N 3.2Å; Y155-E158 PolarHBondContact O-N 3.42Å; Y155-Y159 WeakPolarHBondContact O-CB 3.4Å; Y155-Y159 PolarHBondContact O-N 3.23Å
156	D	96.6	Very high	96	Very high	91 Å²	91	99.3 Å²	99.3	49%	0.487	47%	0.473	S	S	.	.	H	α-helix	trans	-62	-42.7	178.3	-75.1	-16.2	0	0	0	112.4	E152 K154 Y159 S160	E152-D156 PolarHBondContact O-N 2.8Å; E152-D156 VanDerWaalsContact O-N 3.1Å; K154-D156 PolarHBondContact O-N 3.22Å; D156-Y159 PolarHBondContact O-N 2.93Å; D156-S160 PolarHBondContact O-N 3.43Å
157	L	96.5	Very high	96.3	Very high	120 Å²	120	102 Å²	102	63%	0.628	49%	0.487	S	S	*	.	H	α-helix	trans	-62.2	-47.6	175.6	-73.4	172.1	0	0	0	111.4	L153 K154 Y155 Y159 S160 V161	L153-L157 VanDerWaalsContact O-CG 3.31Å; L153-L157 WeakPolarHBondContact O-CG 3.47Å; L153-L157 PolarHBondContact O-N 2.86Å; L153-L157 VanDerWaalsContact O-N 3.14Å; K154-L157 PolarHBondContact O-N 3.1Å; Y155-L157 PolarHBondContact O-N 3.2Å; L157-Y159 VanDerWaalsContact C-N 3.32Å; L157-Y159 PolarHBondContact O-N 2.9Å; L157-S160 PolarHBondContact O-N 3.36Å; L157-V161 VanDerWaalsContact O-CG2 3.3Å; L157-V161 WeakPolarHBondContact O-CG2 3.45Å; L157-V161 PolarHBondContact O-N 2.91Å
158	E	97.7	Very high	96.5	Very high	94 Å²	94	102.8 Å²	102.8	44%	0.439	49%	0.491	S	S	.	.	H	α-helix	trans	-63.6	-37.2	178	-73.7	179.3	169.5	0	0	112.2	K154 Y155 R162	K154-E158 WeakPolarHBondContact CE-OE1 3.42Å; K154-E158 HydrophobicContact CG-CG 4.37Å; K154-E158 IonicContact NZ-OE1 3.57Å; K154-E158 WeakPolarHBondContact O-CB 3.18Å; K154-E158 WeakPolarHBondContact O-CG 3.37Å; K154-E158 PolarHBondContact O-N 2.82Å; Y155-E158 PolarHBondContact O-N 3.42Å; E158-R162 WeakPolarHBondContact O-CB 3.28Å; E158-R162 WeakPolarHBondContact O-CG 3.18Å; E158-R162 PolarHBondContact O-N 3.33Å
159	Y	98.1	Very high	96.6	Very high	129 Å²	129	104.1 Å²	104.1	51%	0.506	49%	0.494	S	S	.	.	H	α-helix	trans	-63.2	-47.9	173.4	-178	-97.4	0	0	0	111.6	Y155 D156 L157 V161 R162 Q163	Y155-Y159 WeakPolarHBondContact O-CB 3.4Å; Y155-Y159 PolarHBondContact O-N 3.23Å; D156-Y159 PolarHBondContact O-N 2.93Å; L157-Y159 VanDerWaalsContact C-N 3.32Å; L157-Y159 PolarHBondContact O-N 2.9Å; Y159-V161 VanDerWaalsContact C-N 3.34Å; Y159-V161 PolarHBondContact O-N 3.35Å; Y159-R162 PolarHBondContact O-N 3.45Å; Y159-Q163 PolarHBondContact O-N 3.35Å
160	S	97.5	Very high	96.7	Very high	40 Å²	40	103.9 Å²	103.9	28%	0.28	49%	0.492	S	S	.	.	H	α-helix	trans	-61.7	-40.4	177.3	-174.4	0	0	0	0	112.5	D156 L157 Q163 K164	D156-S160 PolarHBondContact O-N 3.43Å; L157-S160 PolarHBondContact O-N 3.36Å; S160-Q163 PolarHBondContact O-N 3.49Å; S160-K164 WeakPolarHBondContact O-CG 3.45Å; S160-K164 PolarHBondContact O-N 2.98Å
161	V	98.3	Very high	96.8	Very high	80 Å²	80	104.5 Å²	104.5	49%	0.485	50%	0.496	S	S	.	.	H	α-helix	trans	-61.7	-48.8	175.4	170.2	0	0	0	0	110.5	L157 Y159 Q163 K164 D165	L157-V161 VanDerWaalsContact O-CG2 3.3Å; L157-V161 WeakPolarHBondContact O-CG2 3.45Å; L157-V161 PolarHBondContact O-N 2.91Å; Y159-V161 VanDerWaalsContact C-N 3.34Å; Y159-V161 PolarHBondContact O-N 3.35Å; V161-Q163 VanDerWaalsContact C-N 3.3Å; V161-Q163 PolarHBondContact O-N 2.92Å; V161-K164 PolarHBondContact O-N 3.39Å; V161-K164 VanDerWaalsContact O-N 3.14Å; V161-D165 PolarHBondContact O-N 2.91Å
162	R	97.9	Very high	96.7	Very high	144 Å²	144	103 Å²	103	54%	0.543	49%	0.494	S	S	.	.	H	α-helix	trans	-58.5	-40.7	177.3	-76.3	-174.4	-67.6	161.7	-3.3	112.8	E158 Y159 D165 F166	E158-R162 WeakPolarHBondContact O-CB 3.28Å; E158-R162 WeakPolarHBondContact O-CG 3.18Å; E158-R162 PolarHBondContact O-N 3.33Å; Y159-R162 PolarHBondContact O-N 3.45Å; R162-D165 PolarHBondContact O-N 3.11Å; R162-F166 PolarHBondContact O-N 3.04Å
163	Q	98.3	Very high	96.3	Very high	114 Å²	114	100.2 Å²	100.2	53%	0.533	48%	0.483	S	S	.	.	H	α-helix	trans	-63	-43.9	176.8	-173	179	18.9	0	0	111.7	Y159 S160 V161 F166 E167	Y159-Q163 PolarHBondContact O-N 3.35Å; S160-Q163 PolarHBondContact O-N 3.49Å; V161-Q163 VanDerWaalsContact C-N 3.3Å; V161-Q163 PolarHBondContact O-N 2.92Å; Q163-F166 WeakPolarHBondContact O-CB 3.34Å; Q163-F166 PolarHBondContact O-N 3.24Å; Q163-E167 PolarHBondContact O-N 3.23Å
164	K	98	Very high	96.1	Very high	116 Å²	116	100.8 Å²	100.8	50%	0.504	48%	0.483	S	S	.	.	H	α-helix	trans	-66.8	-39.3	177.2	-71.6	171.2	-176.9	164.7	0	112.3	S160 V161 F166 E167 I168	S160-K164 WeakPolarHBondContact O-CG 3.45Å; S160-K164 PolarHBondContact O-N 2.98Å; V161-K164 PolarHBondContact O-N 3.39Å; V161-K164 VanDerWaalsContact O-N 3.14Å; K164-F166 VanDerWaalsContact C-N 3.31Å; K164-F166 PolarHBondContact O-N 2.91Å; K164-E167 PolarHBondContact O-N 2.89Å; K164-I168 WeakPolarHBondContact O-CB 3.36Å; K164-I168 VanDerWaalsContact O-CG1 3.23Å; K164-I168 WeakPolarHBondContact O-CG1 3.38Å; K164-I168 PolarHBondContact O-N 3.34Å
165	D	98	Very high	95.7	Very high	93 Å²	93	99.6 Å²	99.6	50%	0.497	49%	0.486	S	S	.	.	H	α-helix	trans	-63	-40.3	176	-72.8	-24.7	0	0	0	111.3	V161 R162 I168 N169	V161-D165 PolarHBondContact O-N 2.91Å; R162-D165 PolarHBondContact O-N 3.11Å; D165-I168 PolarHBondContact O-N 3.49Å; D165-N169 WeakPolarHBondContact O-CB 3.33Å; D165-N169 PolarHBondContact O-N 2.91Å
166	F	97.5	Very high	95.1	Very high	131 Å²	131	98.4 Å²	98.4	58%	0.575	49%	0.489	S	S	*	.	H	α-helix	trans	-61.3	-48.8	172.5	178.2	-97.2	0	0	0	111.5	R162 Q163 K164 I168 N169 E170	R162-F166 PolarHBondContact O-N 3.04Å; Q163-F166 WeakPolarHBondContact O-CB 3.34Å; Q163-F166 PolarHBondContact O-N 3.24Å; K164-F166 VanDerWaalsContact C-N 3.31Å; K164-F166 PolarHBondContact O-N 2.91Å; F166-I168 PolarHBondContact O-N 2.95Å; F166-N169 WeakPolarHBondContact O-CB 3.48Å; F166-N169 PolarHBondContact O-N 3.37Å; F166-N169 VanDerWaalsContact O-N 3.16Å; F166-E170 HydrophobicContact CD1-CG 4.17Å; F166-E170 HydrophobicContact CE1-CG 3.68Å; F166-E170 HydrophobicContact CE2-CG 4.17Å; F166-E170 HydrophobicContact CZ-CG 3.68Å; F166-E170 WeakPolarHBondContact O-CG 3.36Å; F166-E170 PolarHBondContact O-N 3.47Å
167	E	97.8	Very high	94.4	Very high	112 Å²	112	99.8 Å²	99.8	52%	0.523	50%	0.496	S	S	.	.	H	α-helix	trans	-60.6	-42.5	177.4	-174.2	178.2	-173.1	0	0	112.4	Q163 K164 N169 E170 L171	Q163-E167 PolarHBondContact O-N 3.23Å; K164-E167 PolarHBondContact O-N 2.89Å; E167-N169 VanDerWaalsContact C-N 3.31Å; E167-N169 PolarHBondContact O-N 3.03Å; E167-E170 PolarHBondContact O-N 2.72Å; E167-L171 HydrophobicContact CG-CD1 4.09Å; E167-L171 HydrophobicContact CG-CG 4.43Å; E167-L171 WeakPolarHBondContact O-CB 3.35Å; E167-L171 VanDerWaalsContact O-CG 3.27Å; E167-L171 WeakPolarHBondContact O-CG 3.45Å; E167-L171 PolarHBondContact O-N 3.43Å
168	I	96.9	Very high	93.7	Very high	99 Å²	99	101.1 Å²	101.1	51%	0.508	50%	0.503	S	S	.	.	H	α-helix	trans	-61	-41.8	175.3	-71.8	164.5	0	0	0	110.7	K164 D165 F166 T172	K164-I168 WeakPolarHBondContact O-CB 3.36Å; K164-I168 VanDerWaalsContact O-CG1 3.23Å; K164-I168 WeakPolarHBondContact O-CG1 3.38Å; K164-I168 PolarHBondContact O-N 3.34Å; D165-I168 PolarHBondContact O-N 3.49Å; F166-I168 PolarHBondContact O-N 2.95Å; I168-T172 VanDerWaalsContact O-CB 3.29Å; I168-T172 WeakPolarHBondContact O-CB 3.46Å; I168-T172 PolarHBondContact O-N 3.01Å; I168-T172 PolarHBondContact O-OG1 2.96Å
169	N	95.5	Very high	92.7	Very high	87 Å²	87	104.4 Å²	104.4	47%	0.465	51%	0.511	S	S	.	.	H	α-helix	trans	-64	-47.3	177	-177.5	59.6	0	0	0	111.4	D165 F166 E167 L171 T172 I173	D165-N169 WeakPolarHBondContact O-CB 3.33Å; D165-N169 PolarHBondContact O-N 2.91Å; F166-N169 WeakPolarHBondContact O-CB 3.48Å; F166-N169 PolarHBondContact O-N 3.37Å; F166-N169 VanDerWaalsContact O-N 3.16Å; E167-N169 VanDerWaalsContact C-N 3.31Å; E167-N169 PolarHBondContact O-N 3.03Å; N169-L171 PolarHBondContact O-N 3.31Å; N169-T172 WeakPolarHBondContact O-CB 3.31Å; N169-T172 PolarHBondContact O-N 2.8Å; N169-T172 VanDerWaalsContact O-N 3.15Å; N169-I173 WeakPolarHBondContact O-CG1 3.38Å; N169-I173 PolarHBondContact O-N 3.28Å
170	E	95.9	Very high	91.5	Very high	69 Å²	69	100.1 Å²	100.1	32%	0.322	51%	0.507	S	S	.	.	H	α-helix	trans	-60	-45.5	176.5	-70.7	-56.7	120.1	0	0	112	F166 E167 T172 I173 Q174	F166-E170 HydrophobicContact CD1-CG 4.17Å; F166-E170 HydrophobicContact CE1-CG 3.68Å; F166-E170 HydrophobicContact CE2-CG 4.17Å; F166-E170 HydrophobicContact CZ-CG 3.68Å; F166-E170 WeakPolarHBondContact O-CG 3.36Å; F166-E170 PolarHBondContact O-N 3.47Å; E167-E170 PolarHBondContact O-N 2.72Å; E170-T172 VanDerWaalsContact C-N 3.3Å; E170-T172 PolarHBondContact O-N 3.49Å; E170-I173 PolarHBondContact O-N 3.35Å; E170-Q174 WeakPolarHBondContact O-CG 3.26Å; E170-Q174 PolarHBondContact O-N 3.24Å
171	L	95	Very high	90.3	Very high	82 Å²	82	108.7 Å²	108.7	43%	0.429	54%	0.539	S	S	.	.	H	α-helix	trans	-64.3	-35.8	175.6	-71.2	174.1	0	0	0	112	E167 N169 I173 Q174 V175	E167-L171 HydrophobicContact CG-CD1 4.09Å; E167-L171 HydrophobicContact CG-CG 4.43Å; E167-L171 WeakPolarHBondContact O-CB 3.35Å; E167-L171 VanDerWaalsContact O-CG 3.27Å; E167-L171 WeakPolarHBondContact O-CG 3.45Å; E167-L171 PolarHBondContact O-N 3.43Å; N169-L171 PolarHBondContact O-N 3.31Å; L171-I173 VanDerWaalsContact C-N 3.34Å; L171-Q174 PolarHBondContact O-N 2.97Å; L171-V175 WeakPolarHBondContact O-CB 3.27Å; L171-V175 WeakPolarHBondContact O-CG2 3.48Å; L171-V175 PolarHBondContact O-N 3.21Å
172	T	91.5	Very high	89	Confident	86 Å²	86	112.3 Å²	112.3	53%	0.528	55%	0.549	S	S	.	.	H	α-helix	trans	-64.2	-41.2	175.8	-62.3	0	0	0	0	111.1	I168 N169 E170 N176	I168-T172 VanDerWaalsContact O-CB 3.29Å; I168-T172 WeakPolarHBondContact O-CB 3.46Å; I168-T172 PolarHBondContact O-N 3.01Å; I168-T172 PolarHBondContact O-OG1 2.96Å; N169-T172 WeakPolarHBondContact O-CB 3.31Å; N169-T172 PolarHBondContact O-N 2.8Å; N169-T172 VanDerWaalsContact O-N 3.15Å; E170-T172 VanDerWaalsContact C-N 3.3Å; E170-T172 PolarHBondContact O-N 3.49Å; T172-N176 WeakPolarHBondContact O-CB 3.49Å; T172-N176 PolarHBondContact O-N 3.43Å
173	I	88.8	Confident	87.8	Confident	75 Å²	75	110.4 Å²	110.4	39%	0.385	55%	0.553	S	S	.	*	H	α-helix	trans	-63.3	-51.3	174.3	-65.9	163.8	0	0	0	110.1	N169 E170 L171 V175 N176 D177	N169-I173 WeakPolarHBondContact O-CG1 3.38Å; N169-I173 PolarHBondContact O-N 3.28Å; E170-I173 PolarHBondContact O-N 3.35Å; L171-I173 VanDerWaalsContact C-N 3.34Å; I173-V175 VanDerWaalsContact C-N 3.34Å; I173-V175 PolarHBondContact O-N 2.66Å; I173-N176 WeakPolarHBondContact O-CA 3.28Å; I173-N176 VanDerWaalsContact O-CB 3.25Å; I173-N176 WeakPolarHBondContact O-CB 2.99Å; I173-N176 PolarHBondContact O-N 3.05Å; I173-D177 PolarHBondContact O-N 3.43Å
174	Q	90	Very high	86.7	Confident	101 Å²	101	112.5 Å²	112.5	47%	0.472	56%	0.56	S	S	.	*	H	α-helix	trans	-58.5	-43.8	179	-69.7	174	37.8	0	0	112.3	E170 L171 N176 D177 L178	E170-Q174 WeakPolarHBondContact O-CG 3.26Å; E170-Q174 PolarHBondContact O-N 3.24Å; L171-Q174 PolarHBondContact O-N 2.97Å; Q174-N176 PolarHBondContact O-N 3.23Å; Q174-D177 PolarHBondContact O-N 2.98Å; Q174-L178 VanDerWaalsContact O-CB 3.31Å; Q174-L178 WeakPolarHBondContact O-CB 3.27Å; Q174-L178 WeakPolarHBondContact O-CG 3.09Å; Q174-L178 PolarHBondContact O-N 3.14Å
175	V	86.8	Confident	85.8	Confident	94 Å²	94	110.8 Å²	110.8	57%	0.57	56%	0.561	S	S	*	*	H	α-helix	trans	-63.1	-33.3	175.9	168	0	0	0	0	111.2	L171 I173 R179	L171-V175 WeakPolarHBondContact O-CB 3.27Å; L171-V175 WeakPolarHBondContact O-CG2 3.48Å; L171-V175 PolarHBondContact O-N 3.21Å; I173-V175 VanDerWaalsContact C-N 3.34Å; I173-V175 PolarHBondContact O-N 2.66Å; V175-R179 VanDerWaalsContact O-CB 3.26Å; V175-R179 WeakPolarHBondContact O-CB 3.44Å; V175-R179 PolarHBondContact O-N 3.37Å
176	N	83.8	Confident	85	Confident	110 Å²	110	112.7 Å²	112.7	59%	0.588	58%	0.576	S	S	*	*	H	α-helix	trans	-67.5	-49.5	174.7	-164.5	-54.3	0	0	0	111.6	T172 I173 Q174 L178 R179	T172-N176 WeakPolarHBondContact O-CB 3.49Å; T172-N176 PolarHBondContact O-N 3.43Å; I173-N176 WeakPolarHBondContact O-CA 3.28Å; I173-N176 VanDerWaalsContact O-CB 3.25Å; I173-N176 WeakPolarHBondContact O-CB 2.99Å; I173-N176 PolarHBondContact O-N 3.05Å; Q174-N176 PolarHBondContact O-N 3.23Å; N176-L178 VanDerWaalsContact C-N 3.32Å; N176-L178 PolarHBondContact O-N 2.87Å; N176-R179 WeakPolarHBondContact O-CB 3.46Å; N176-R179 PolarHBondContact O-N 3.49Å
177	D	83.3	Confident	84.1	Confident	119 Å²	119	113.6 Å²	113.6	64%	0.636	59%	0.586	S	S	*	*	H	α-helix	trans	-61.4	-41.9	178.8	-70.3	-20.1	0	0	0	111.5	I173 Q174 G180	I173-D177 PolarHBondContact O-N 3.43Å; Q174-D177 PolarHBondContact O-N 2.98Å; D177-G180 PolarHBondContact O-N 3.44Å
178	L	81.9	Confident	83.2	Confident	148 Å²	148	116.9 Å²	116.9	78%	0.775	60%	0.599	S	S	*	*	H	α-helix	trans	-67.3	-34.2	176.3	-70.7	175.1	0	0	0	113.1	Q174 N176 G180	Q174-L178 VanDerWaalsContact O-CB 3.31Å; Q174-L178 WeakPolarHBondContact O-CB 3.27Å; Q174-L178 WeakPolarHBondContact O-CG 3.09Å; Q174-L178 PolarHBondContact O-N 3.14Å; N176-L178 VanDerWaalsContact C-N 3.32Å; N176-L178 PolarHBondContact O-N 2.87Å; L178-G180 PolarHBondContact O-N 3.13Å; L178-G180 VanDerWaalsContact O-N 3.11Å
179	R	75.5	Confident	82.4	Confident	163 Å²	163	122.5 Å²	122.5	62%	0.615	62%	0.619	S	S	*	*	H	α-helix	trans	-61.2	-20.1	176.1	-173.4	173.5	175	-174.5	-3.4	111.3	V175 N176	V175-R179 VanDerWaalsContact O-CB 3.26Å; V175-R179 WeakPolarHBondContact O-CB 3.44Å; V175-R179 PolarHBondContact O-N 3.37Å; N176-R179 WeakPolarHBondContact O-CB 3.46Å; N176-R179 PolarHBondContact O-N 3.49Å
180	G	73.4	Confident	81.3	Confident	40 Å²	40	122.6 Å²	122.6	41%	0.412	62%	0.623	S	S	.	*			trans	65.8	169.9	177	0	0	0	0	0	112.4	D177 L178 F182	D177-G180 PolarHBondContact O-N 3.44Å; L178-G180 PolarHBondContact O-N 3.13Å; L178-G180 VanDerWaalsContact O-N 3.11Å; G180-F182 PolarHBondContact O-N 3.43Å
181	K	72.4	Confident	80.5	Confident	220 Å²	220	122.6 Å²	122.6	96%	0.957	63%	0.631	S	S	*	*	S	Bend	trans	-59.2	-5.5	177.5	65.9	-176.8	177	-174.7	0	114.9	V183	K181-V183 VanDerWaalsContact C-N 3.32Å; K181-V183 PolarHBondContact O-N 3.45Å; K181-V183 VanDerWaalsContact O-N 3.11Å
182	F	69.9	Low	79.2	Confident	156 Å²	156	127.5 Å²	127.5	68%	0.684	65%	0.648	S	S	*	*			trans	-86.3	74.4	177.4	-165.1	-101.5	0	0	0	110.5	G180 K184	G180-F182 PolarHBondContact O-N 3.43Å; F182-K184 PolarHBondContact O-N 3.46Å
183	V	73.5	Confident	78	Confident	104 Å²	104	130.8 Å²	130.8	63%	0.63	65%	0.652	S	S	*	*			trans	-62.3	110.5	165.5	177.1	0	0	0	0	107.4	K181 P185	K181-V183 VanDerWaalsContact C-N 3.32Å; K181-V183 PolarHBondContact O-N 3.45Å; K181-V183 VanDerWaalsContact O-N 3.11Å; V183-P185 WeakPolarHBondContact O-CD 3.5Å
184	K	75.5	Confident	77	Confident	158 Å²	158	131.3 Å²	131.3	69%	0.687	66%	0.656	S	S	*	*			trans	-50.1	111.7	177.5	-175.6	177.1	-176.6	179	0	108.9	F182 T186	F182-K184 PolarHBondContact O-N 3.46Å; K184-T186 PolarHBondContact O-N 3.02Å
185	P	79.4	Confident	75.8	Confident	79 Å²	79	130.5 Å²	130.5	51%	0.513	66%	0.655	S	S	.	*			trans	-65.1	141.4	-177.5	24.2	-31.7	0	0	0	109	V183 L187	V183-P185 WeakPolarHBondContact O-CD 3.5Å; P185-L187 VanDerWaalsContact O-CD1 3.26Å; P185-L187 WeakPolarHBondContact O-CD1 3.38Å; P185-L187 PolarHBondContact O-N 3.42Å
186	T	81.6	Confident	74.7	Confident	134 Å²	134	132.8 Å²	132.8	82%	0.822	66%	0.657	S	S	*	*			trans	-65.4	106.7	168.5	48.9	0	0	0	0	108.3	K184 K188	K184-T186 PolarHBondContact O-N 3.02Å; T186-K188 PolarHBondContact O-N 2.78Å; T186-K188 VanDerWaalsContact O-N 3.15Å
187	L	78.3	Confident	73.8	Confident	149 Å²	149	133.6 Å²	133.6	78%	0.78	66%	0.655	S	S	*	*			trans	-63.4	116.1	176.9	-81.8	71.3	0	0	0	109.4	P185	P185-L187 VanDerWaalsContact O-CD1 3.26Å; P185-L187 WeakPolarHBondContact O-CD1 3.38Å; P185-L187 PolarHBondContact O-N 3.42Å
188	K	79.5	Confident	73	Confident	182 Å²	182	133.8 Å²	133.8	79%	0.791	65%	0.651	S	S	*	*			trans	-70.6	141.3	165.2	-66.7	-174.1	-178.5	-177.9	0	108.7	T186 V190	T186-K188 PolarHBondContact O-N 2.78Å; T186-K188 VanDerWaalsContact O-N 3.15Å; K188-V190 PolarHBondContact O-N 3.43Å
189	K	79.7	Confident	72.2	Confident	216 Å²	216	133.8 Å²	133.8	94%	0.939	64%	0.644	S	S	*	*			trans	-64	102.2	172.3	-67.8	-172.7	-161.1	174.5	0	108.5
190	V	72.7	Confident	71.6	Confident	89 Å²	89	130 Å²	130	54%	0.539	64%	0.636	S	S	.	*			trans	-89.6	117.3	166.2	-89.8	0	0	0	0	107.3	K188 N195	K188-V190 PolarHBondContact O-N 3.43Å; V190-N195 WeakPolarHBondContact CG1-ND2 3.18Å
191	S	78.5	Confident	71.2	Confident	70 Å²	70	130.8 Å²	130.8	49%	0.49	64%	0.638	S	S	.	*			trans	-62.4	140	165.6	95.5	0	0	0	0	107	Y193 D194	S191-Y193 PolarHBondContact O-N 3.24Å; S191-D194 PolarHBondContact O-N 3.17Å; S191-D194 VanDerWaalsContact OG-CB 3.31Å; S191-D194 WeakPolarHBondContact OG-CB 3.36Å; S191-D194 PolarHBondContact OG-N 3.48Å; S191-D194 VanDerWaalsContact OG-N 3.1Å
192	K	68.2	Low	70.8	Confident	185 Å²	185	126.2 Å²	126.2	80%	0.804	62%	0.62	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56.8	-17.2	-175.7	-67	-175.5	-175.4	-177.1	0	113.4
193	Y	66.5	Low	70.3	Confident	155 Å²	155	124.1 Å²	124.1	61%	0.608	61%	0.611	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.9	-26.3	-174.3	-67.6	-75.4	0	0	0	113.5	S191 N195 K196 F197	S191-Y193 PolarHBondContact O-N 3.24Å; Y193-N195 PolarHBondContact O-N 3.1Å; Y193-K196 PolarHBondContact O-N 3.47Å; Y193-F197 HydrophobicContact CD1-CE2 4.14Å; Y193-F197 HydrophobicContact CG-CE2 4.23Å; Y193-F197 WeakPolarHBondContact O-CD2 3.48Å; Y193-F197 WeakPolarHBondContact O-CG 3.4Å; Y193-F197 PolarHBondContact O-N 2.96Å
194	D	67.2	Low	69.7	Low	85 Å²	85	126.5 Å²	126.5	46%	0.455	61%	0.612	S	S	.	*	H	α-helix	trans	-60	-44.8	-174.9	-171.7	64.1	0	0	0	112.9	S191 K196 F197 K198	S191-D194 PolarHBondContact O-N 3.17Å; S191-D194 VanDerWaalsContact OG-CB 3.31Å; S191-D194 WeakPolarHBondContact OG-CB 3.36Å; S191-D194 PolarHBondContact OG-N 3.48Å; S191-D194 VanDerWaalsContact OG-N 3.1Å; D194-K196 PolarHBondContact O-N 3.08Å; D194-F197 PolarHBondContact O-N 2.92Å; D194-K198 PolarHBondContact O-N 2.96Å
195	N	65.4	Low	69.1	Low	84 Å²	84	127.8 Å²	127.8	45%	0.449	62%	0.618	S	S	.	*	H	α-helix	trans	-72	-31.3	-178.9	-72.8	-36	0	0	0	114	V190 Y193 K199	V190-N195 WeakPolarHBondContact CG1-ND2 3.18Å; Y193-N195 PolarHBondContact O-N 3.1Å; N195-K199 PolarHBondContact O-N 3.17Å
196	K	63.5	Low	68.1	Low	142 Å²	142	131.1 Å²	131.1	62%	0.617	63%	0.627	S	S	*	*	H	α-helix	trans	-72.1	-38	175.7	-61.8	-173.9	-167.3	-173.7	0	109.7	Y193 D194 I200	Y193-K196 PolarHBondContact O-N 3.47Å; D194-K196 PolarHBondContact O-N 3.08Å; K196-I200 WeakPolarHBondContact O-CB 3.2Å; K196-I200 WeakPolarHBondContact O-CD1 3.47Å; K196-I200 WeakPolarHBondContact O-CG1 3.37Å; K196-I200 PolarHBondContact O-N 3.31Å
197	F	64.7	Low	67.1	Low	127 Å²	127	132 Å²	132	56%	0.557	63%	0.626	S	S	*	*	H	α-helix	trans	-72.4	-36.5	177.9	-70.2	-54.1	0	0	0	113.4	Y193 D194 I200 A201	Y193-F197 HydrophobicContact CD1-CE2 4.14Å; Y193-F197 HydrophobicContact CG-CE2 4.23Å; Y193-F197 WeakPolarHBondContact O-CD2 3.48Å; Y193-F197 WeakPolarHBondContact O-CG 3.4Å; Y193-F197 PolarHBondContact O-N 2.96Å; D194-F197 PolarHBondContact O-N 2.92Å; F197-I200 PolarHBondContact O-N 2.75Å; F197-A201 WeakPolarHBondContact O-CA 3.44Å; F197-A201 WeakPolarHBondContact O-CB 3.17Å; F197-A201 PolarHBondContact O-N 3.49Å
198	K	66.4	Low	66.3	Low	124 Å²	124	133.3 Å²	133.3	54%	0.539	63%	0.626	S	S	.	*	H	α-helix	trans	-61.5	-47.2	172	-108.2	-172.3	176.3	-173.2	0	112.3	D194 I200 A201 E202	D194-K198 PolarHBondContact O-N 2.96Å; K198-I200 VanDerWaalsContact C-N 3.33Å; K198-I200 PolarHBondContact O-N 3.43Å; K198-A201 PolarHBondContact O-N 3.41Å; K198-E202 WeakPolarHBondContact O-CB 3.12Å; K198-E202 WeakPolarHBondContact O-CG 3.24Å; K198-E202 PolarHBondContact O-N 3.38Å
199	K	64.5	Low	65.7	Low	148 Å²	148	128.9 Å²	128.9	64%	0.643	61%	0.61	S	S	*	*	H	α-helix	trans	-62.2	-39.7	176	-80.5	-177.2	176.6	179.8	0	112.6	N195 K203	N195-K199 PolarHBondContact O-N 3.17Å; K199-K203 WeakPolarHBondContact O-CB 3.49Å; K199-K203 VanDerWaalsContact O-CG 3.24Å; K199-K203 WeakPolarHBondContact O-CG 3.17Å; K199-K203 PolarHBondContact O-N 3.24Å
200	I	63	Low	65.4	Low	84 Å²	84	124.4 Å²	124.4	43%	0.431	60%	0.596	S	S	.	*	H	α-helix	trans	-71.1	-37	176.3	-68.5	164.2	0	0	0	110.7	K196 F197 K198 K204	K196-I200 WeakPolarHBondContact O-CB 3.2Å; K196-I200 WeakPolarHBondContact O-CD1 3.47Å; K196-I200 WeakPolarHBondContact O-CG1 3.37Å; K196-I200 PolarHBondContact O-N 3.31Å; F197-I200 PolarHBondContact O-N 2.75Å; K198-I200 VanDerWaalsContact C-N 3.33Å; K198-I200 PolarHBondContact O-N 3.43Å; I200-K204 HydrophobicContact CG2-CD 4.07Å; I200-K204 HydrophobicContact CG2-CG 4.24Å; I200-K204 WeakPolarHBondContact O-CB 3.28Å; I200-K204 WeakPolarHBondContact O-CG 3.4Å; I200-K204 PolarHBondContact O-N 3.21Å
201	A	65.9	Low	65.5	Low	56 Å²	56	127.8 Å²	127.8	46%	0.463	60%	0.604	S	S	.	*	H	α-helix	trans	-73.4	-41.1	-179.4	0	0	0	0	0	112.3	F197 K198 K204 K205	F197-A201 WeakPolarHBondContact O-CA 3.44Å; F197-A201 WeakPolarHBondContact O-CB 3.17Å; F197-A201 PolarHBondContact O-N 3.49Å; K198-A201 PolarHBondContact O-N 3.41Å; A201-K204 PolarHBondContact O-N 3.07Å; A201-K205 PolarHBondContact O-N 3.41Å
202	E	63.5	Low	65.3	Low	124 Å²	124	134.3 Å²	134.3	58%	0.579	62%	0.618	S	S	*	*	H	α-helix	trans	-67.7	-43.7	172.4	-73.7	168.5	-177.8	0	0	110.3	K198 K204 K205	K198-E202 WeakPolarHBondContact O-CB 3.12Å; K198-E202 WeakPolarHBondContact O-CG 3.24Å; K198-E202 PolarHBondContact O-N 3.38Å; E202-K204 VanDerWaalsContact C-N 3.34Å; E202-K204 PolarHBondContact O-N 3.14Å; E202-K205 PolarHBondContact O-N 2.99Å
203	K	58.6	Low	65.5	Low	112 Å²	112	129.5 Å²	129.5	49%	0.487	61%	0.612	S	S	.	*	H	α-helix	trans	-69.4	-25.4	174.5	-75.5	-175.2	169.9	-166.9	0	114.4	K199 K205 E206	K199-K203 WeakPolarHBondContact O-CB 3.49Å; K199-K203 VanDerWaalsContact O-CG 3.24Å; K199-K203 WeakPolarHBondContact O-CG 3.17Å; K199-K203 PolarHBondContact O-N 3.24Å; K203-K205 PolarHBondContact O-N 3.31Å; K203-E206 CarbonylContact O-C 3.51Å; K203-E206 PolarHBondContact O-N 2.92Å
204	K	61.8	Low	65.8	Low	153 Å²	153	129.6 Å²	129.6	67%	0.665	62%	0.624	S	S	*	*	H	α-helix	trans	-71.5	-19.4	172.9	-87.1	-177.4	176.9	-169	0	112.6	I200 A201 E202 E206	I200-K204 HydrophobicContact CG2-CD 4.07Å; I200-K204 HydrophobicContact CG2-CG 4.24Å; I200-K204 WeakPolarHBondContact O-CB 3.28Å; I200-K204 WeakPolarHBondContact O-CG 3.4Å; I200-K204 PolarHBondContact O-N 3.21Å; A201-K204 PolarHBondContact O-N 3.07Å; E202-K204 VanDerWaalsContact C-N 3.34Å; E202-K204 PolarHBondContact O-N 3.14Å; K204-E206 VanDerWaalsContact C-N 3.28Å
205	K	61.5	Low	66.2	Low	186 Å²	186	131.2 Å²	131.2	81%	0.809	63%	0.632	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.4	-16.5	171.7	-72.3	-177.9	178.3	-175.6	0	112.5	A201 E202 K203	A201-K205 PolarHBondContact O-N 3.41Å; E202-K205 PolarHBondContact O-N 2.99Å; K203-K205 PolarHBondContact O-N 3.31Å
206	E	59	Low	66.6	Low	149 Å²	149	136.8 Å²	136.8	70%	0.696	65%	0.652	S	S	*	*	S	Bend	trans	-109.7	86	172.5	-68.8	-179.4	171.6	0	0	108.5	K203 K204 K208	K203-E206 CarbonylContact O-C 3.51Å; K203-E206 PolarHBondContact O-N 2.92Å; K204-E206 VanDerWaalsContact C-N 3.28Å; E206-K208 PolarHBondContact O-N 2.93Å
207	D	60.2	Low	67.1	Low	151 Å²	151	137.5 Å²	137.5	81%	0.807	66%	0.661	S	S	*	*	S	Bend	trans	-57.7	7.3	-169.6	-89	-36.9	0	0	0	117.3
208	K	62.7	Low	67.2	Low	177 Å²	177	136.4 Å²	136.4	77%	0.77	66%	0.664	S	S	*	*			trans	-144.2	107	172.8	-66.3	-177.1	-175.3	169.9	0	110.3	E206 D210	E206-K208 PolarHBondContact O-N 2.93Å; K208-D210 PolarHBondContact O-N 3.07Å
209	I	65.8	Low	67.4	Low	89 Å²	89	137.8 Å²	137.8	46%	0.456	67%	0.67	S	S	.	*			trans	-72.3	96.3	172.6	-58.1	165.8	0	0	0	108.1	F211	I209-F211 HydrophobicContact CB-CD2 4.38Å; I209-F211 HydrophobicContact CB-CE2 3.86Å; I209-F211 HydrophobicContact CB-CZ 4.2Å; I209-F211 HydrophobicContact CG2-CD1 4.16Å; I209-F211 HydrophobicContact CG2-CD2 3.83Å; I209-F211 HydrophobicContact CG2-CE1 3.75Å; I209-F211 HydrophobicContact CG2-CE2 3.38Å; I209-F211 HydrophobicContact CG2-CG 4.21Å; I209-F211 HydrophobicContact CG2-CZ 3.34Å; I209-F211 VanDerWaalsContact O-CD2 3.28Å; I209-F211 WeakPolarHBondContact O-CD2 3.29Å; I209-F211 PolarHBondContact O-N 3.37Å
210	D	73.9	Confident	67.5	Low	123 Å²	123	139.3 Å²	139.3	66%	0.658	68%	0.677	S	S	*	*			trans	-76.9	86	176	-90.2	-38.4	0	0	0	111.7	K208 R212 A213	K208-D210 PolarHBondContact O-N 3.07Å; D210-R212 PolarHBondContact O-N 3.14Å; D210-R212 VanDerWaalsContact O-N 3.14Å; D210-A213 HydrophobicContact CB-CB 4.38Å; D210-A213 PolarHBondContact O-N 3.13Å
211	F	74.5	Confident	67.4	Low	160 Å²	160	141.2 Å²	141.2	70%	0.702	69%	0.688	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.6	-13.2	174.4	-66.6	-79.7	0	0	0	113.9	I209	I209-F211 HydrophobicContact CB-CD2 4.38Å; I209-F211 HydrophobicContact CB-CE2 3.86Å; I209-F211 HydrophobicContact CB-CZ 4.2Å; I209-F211 HydrophobicContact CG2-CD1 4.16Å; I209-F211 HydrophobicContact CG2-CD2 3.83Å; I209-F211 HydrophobicContact CG2-CE1 3.75Å; I209-F211 HydrophobicContact CG2-CE2 3.38Å; I209-F211 HydrophobicContact CG2-CG 4.21Å; I209-F211 HydrophobicContact CG2-CZ 3.34Å; I209-F211 VanDerWaalsContact O-CD2 3.28Å; I209-F211 WeakPolarHBondContact O-CD2 3.29Å; I209-F211 PolarHBondContact O-N 3.37Å
212	R	74.2	Confident	67.1	Low	207 Å²	207	142 Å²	142	78%	0.781	69%	0.687	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84	-23.9	179.1	-87.4	-176.9	158.7	79	0.7	114	D210 N214 L215	D210-R212 PolarHBondContact O-N 3.14Å; D210-R212 VanDerWaalsContact O-N 3.14Å; R212-N214 VanDerWaalsContact C-N 3.28Å; R212-N214 PolarHBondContact O-N 3.02Å; R212-L215 PolarHBondContact O-N 3.04Å; R212-L215 VanDerWaalsContact O-N 3.14Å
213	A	71.9	Confident	66.9	Low	83 Å²	83	139.8 Å²	139.8	69%	0.686	68%	0.682	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.8	-32.3	-175.4	0	0	0	0	0	113	D210	D210-A213 HydrophobicContact CB-CB 4.38Å; D210-A213 PolarHBondContact O-N 3.13Å
214	N	74.6	Confident	66.9	Low	158 Å²	158	141 Å²	141	85%	0.845	69%	0.689	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.1	-0.4	178.6	-102.1	76.4	0	0	0	114.1	R212	R212-N214 VanDerWaalsContact C-N 3.28Å; R212-N214 PolarHBondContact O-N 3.02Å
215	L	75	Confident	66.6	Low	119 Å²	119	140.4 Å²	140.4	62%	0.623	69%	0.689	S	S	*	*	S	Bend	trans	-90.2	124.1	177.9	-67.8	173.8	0	0	0	109.5	R212 I217	R212-L215 PolarHBondContact O-N 3.04Å; R212-L215 VanDerWaalsContact O-N 3.14Å; L215-I217 PolarHBondContact O-N 3.34Å; L215-I217 VanDerWaalsContact O-N 3.07Å
216	K	74	Confident	66.5	Low	200 Å²	200	136.2 Å²	136.2	87%	0.87	68%	0.675	S	S	*	*			trans	-61	112.8	171.1	-67.9	-178.6	179.3	-179.6	0	108.2	V218	K216-V218 PolarHBondContact O-N 3.14Å; K216-V218 VanDerWaalsContact O-N 3.13Å
217	I	74.1	Confident	66.5	Low	157 Å²	157	136.3 Å²	136.3	81%	0.805	67%	0.673	S	S	*	*			trans	-72.4	106.3	172.9	-57.8	164	0	0	0	106.4	L215 K219	L215-I217 PolarHBondContact O-N 3.34Å; L215-I217 VanDerWaalsContact O-N 3.07Å; I217-K219 PolarHBondContact O-N 3.38Å
218	V	66.6	Low	66.4	Low	104 Å²	104	136.9 Å²	136.9	63%	0.63	67%	0.668	S	S	*	*			trans	-72.6	113.7	172.9	-175.1	0	0	0	0	107	K216	K216-V218 PolarHBondContact O-N 3.14Å; K216-V218 VanDerWaalsContact O-N 3.13Å
219	K	70.1	Confident	66.1	Low	154 Å²	154	135.3 Å²	135.3	67%	0.67	66%	0.663	S	S	*	*			trans	-65.3	134.2	171.2	-71.5	-178.5	178.6	179.3	0	108.4	I217 D221 V222	I217-K219 PolarHBondContact O-N 3.38Å; K219-D221 PolarHBondContact O-N 2.68Å; K219-D221 VanDerWaalsContact O-N 3.15Å; K219-V222 HydrophobicContact CB-CG2 4.37Å; K219-V222 PolarHBondContact O-N 3.39Å
220	K	66	Low	65.6	Low	180 Å²	180	139.8 Å²	139.8	78%	0.783	68%	0.68	S	S	*	*	H	α-helix	trans	-58	-30.5	-174.7	-160.7	168.4	178.3	173.3	0	112.1	V222 T223	K220-V222 VanDerWaalsContact C-N 3.34Å; K220-V222 PolarHBondContact O-N 3.06Å; K220-T223 WeakPolarHBondContact O-CB 3.36Å; K220-T223 PolarHBondContact O-N 3.15Å; K220-T223 VanDerWaalsContact O-N 3.1Å
221	D	62.6	Low	64.8	Low	124 Å²	124	142.3 Å²	142.3	66%	0.663	69%	0.687	S	S	*	*	H	α-helix	trans	-64.3	-35	177.9	-50.5	-36.3	0	0	0	112.9	K219 T223 E224 E225	K219-D221 PolarHBondContact O-N 2.68Å; K219-D221 VanDerWaalsContact O-N 3.15Å; D221-T223 PolarHBondContact O-N 2.75Å; D221-E224 PolarHBondContact O-N 3.26Å; D221-E225 PolarHBondContact O-N 3.26Å
222	V	58.1	Low	63.8	Low	73 Å²	73	142.7 Å²	142.7	44%	0.442	69%	0.691	S	S	.	*	H	α-helix	trans	-67.6	-23.6	177.1	-178.5	0	0	0	0	111.5	K219 K220 L226	K219-V222 HydrophobicContact CB-CG2 4.37Å; K219-V222 PolarHBondContact O-N 3.39Å; K220-V222 VanDerWaalsContact C-N 3.34Å; K220-V222 PolarHBondContact O-N 3.06Å; V222-L226 HydrophobicContact CG1-CD1 3.96Å; V222-L226 HydrophobicContact CG1-CG 4.39Å; V222-L226 WeakPolarHBondContact O-CB 3.43Å; V222-L226 WeakPolarHBondContact O-CG 3.44Å; V222-L226 PolarHBondContact O-N 3.4Å; V222-L226 VanDerWaalsContact O-N 3.14Å
223	T	58.8	Low	63	Low	77 Å²	77	141.5 Å²	141.5	47%	0.472	69%	0.692	S	S	.	*	H	α-helix	trans	-76.1	-32.6	177.7	-51.8	0	0	0	0	111.9	K220 D221 K227	K220-T223 WeakPolarHBondContact O-CB 3.36Å; K220-T223 PolarHBondContact O-N 3.15Å; K220-T223 VanDerWaalsContact O-N 3.1Å; D221-T223 PolarHBondContact O-N 2.75Å; T223-K227 PolarHBondContact O-N 3.14Å
224	E	58.5	Low	62.4	Low	136 Å²	136	142.8 Å²	142.8	64%	0.636	69%	0.693	S	S	*	*	H	α-helix	trans	-69.2	-44.4	172.6	-88.4	-83	131.9	0	0	110.9	D221 L226 K227 K228	D221-E224 PolarHBondContact O-N 3.26Å; E224-L226 PolarHBondContact O-N 3.1Å; E224-K227 WeakPolarHBondContact O-CB 3.37Å; E224-K227 PolarHBondContact O-N 2.67Å; E224-K227 VanDerWaalsContact O-N 3.17Å; E224-K228 PolarHBondContact O-N 3.38Å
225	E	57.3	Low	61.8	Low	141 Å²	141	139.1 Å²	139.1	66%	0.659	68%	0.678	S	S	*	*	H	α-helix	trans	-61.8	-45.2	179.1	-144.6	79.4	-135.7	0	0	112.1	D221 K227 K228 E229	D221-E225 PolarHBondContact O-N 3.26Å; E225-K227 VanDerWaalsContact C-N 3.26Å; E225-K227 PolarHBondContact O-N 3.48Å; E225-K228 PolarHBondContact O-N 3.41Å; E225-E229 PolarHBondContact O-N 3.48Å; E225-E229 VanDerWaalsContact O-N 3.15Å
226	L	57.7	Low	61.2	Low	98 Å²	98	141.8 Å²	141.8	51%	0.513	69%	0.687	S	S	.	*	H	α-helix	trans	-68.7	-22.3	177.7	-76	169.9	0	0	0	113.5	V222 E224 K230	V222-L226 HydrophobicContact CG1-CD1 3.96Å; V222-L226 HydrophobicContact CG1-CG 4.39Å; V222-L226 WeakPolarHBondContact O-CB 3.43Å; V222-L226 WeakPolarHBondContact O-CG 3.44Å; V222-L226 PolarHBondContact O-N 3.4Å; V222-L226 VanDerWaalsContact O-N 3.14Å; E224-L226 PolarHBondContact O-N 3.1Å; L226-K230 PolarHBondContact O-N 3.32Å
227	K	60	Low	61	Low	151 Å²	151	141 Å²	141	66%	0.657	68%	0.679	S	S	*	*	H	α-helix	trans	-73.1	-40.1	174.3	-113.6	-175.8	173.2	-174.6	0	111.1	T223 E224 E225	T223-K227 PolarHBondContact O-N 3.14Å; E224-K227 WeakPolarHBondContact O-CB 3.37Å; E224-K227 PolarHBondContact O-N 2.67Å; E224-K227 VanDerWaalsContact O-N 3.17Å; E225-K227 VanDerWaalsContact C-N 3.26Å; E225-K227 PolarHBondContact O-N 3.48Å
228	K	58	Low	60.7	Low	163 Å²	163	135.6 Å²	135.6	71%	0.709	66%	0.658	S	S	*	*	H	α-helix	trans	-67	-40.1	176.2	-113.5	173.9	177.3	170.3	0	112.2	E224 E225 K230 E231	E224-K228 PolarHBondContact O-N 3.38Å; E225-K228 PolarHBondContact O-N 3.41Å; K228-K230 VanDerWaalsContact C-N 3.3Å; K228-K230 PolarHBondContact O-N 3.15Å; K228-E231 PolarHBondContact O-N 3.38Å
229	E	56	Low	60.5	Low	144 Å²	144	133.8 Å²	133.8	67%	0.673	65%	0.654	S	S	*	*	H	α-helix	trans	-70.5	-25.9	-179.4	-152.4	-179.1	-167.5	0	0	112.9	E225 E231 E232	E225-E229 PolarHBondContact O-N 3.48Å; E225-E229 VanDerWaalsContact O-N 3.15Å; E229-E231 VanDerWaalsContact C-N 3.35Å; E229-E231 PolarHBondContact O-N 3.39Å; E229-E232 PolarHBondContact O-N 3.15Å
230	K	55.7	Low	60	Low	184 Å²	184	133.4 Å²	133.4	80%	0.8	65%	0.654	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.7	-17.8	177.2	-91	-164.3	175.5	-174.4	0	115.1	L226 K228	L226-K230 PolarHBondContact O-N 3.32Å; K228-K230 VanDerWaalsContact C-N 3.3Å; K228-K230 PolarHBondContact O-N 3.15Å
231	E	56.6	Low	59.6	Low	175 Å²	175	129.5 Å²	129.5	82%	0.818	65%	0.645	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.7	-20.9	175.6	-74.9	-167.5	159.4	0	0	112.5	K228 E229 K233	K228-E231 PolarHBondContact O-N 3.38Å; E229-E231 VanDerWaalsContact C-N 3.35Å; E229-E231 PolarHBondContact O-N 3.39Å; E231-K233 PolarHBondContact O-N 3.24Å
232	E	54.9	Low	59.3	Low	168 Å²	168	128.3 Å²	128.3	79%	0.785	65%	0.647	S	S	*	*	S	Bend	trans	-99.6	88.4	176.7	-66.9	-162.4	168	0	0	112.1	E229	E229-E232 PolarHBondContact O-N 3.15Å
233	K	56.2	Low	59.1	Low	183 Å²	183	133.6 Å²	133.6	80%	0.796	66%	0.664	S	S	*	*			trans	80.2	112.8	165.6	-55.9	-167.3	179.9	176.5	0	116.8	E231	E231-K233 PolarHBondContact O-N 3.24Å
234	P	58.5	Low	58.7	Low	110 Å²	110	137.7 Å²	137.7	71%	0.714	68%	0.675	S	S	*	*			trans	-63.9	140.2	169.6	25.8	-31.5	0	0	0	110.6	A238	P234-A238 HydrophobicContact CB-CB 4.5Å
235	P	63.5	Low	58.3	Low	81 Å²	81	133.5 Å²	133.5	53%	0.526	67%	0.669	S	S	.	*			trans	-62.2	148.7	-178.8	-0.2	0.9	0	0	0	112.8	W237 A238	P235-W237 PolarHBondContact O-N 3.17Å; P235-A238 WeakPolarHBondContact O-CB 3.2Å; P235-A238 PolarHBondContact O-N 3.32Å
236	E	61.9	Low	57.9	Low	174 Å²	174	133.6 Å²	133.6	81%	0.813	67%	0.673	S	S	*	*	H	α-helix	trans	-53.2	-27.9	-171.4	-72.9	-170.5	144.1	0	0	115.4	A238 A239 Q240	E236-A238 PolarHBondContact O-N 3.47Å; E236-A239 PolarHBondContact O-N 3.23Å; E236-A239 VanDerWaalsContact O-N 3.14Å; E236-Q240 PolarHBondContact O-N 3.14Å
237	W	69.7	Low	57.4	Low	184 Å²	184	139.4 Å²	139.4	70%	0.697	69%	0.689	S	S	*	*	H	α-helix	trans	-65.2	-28.2	177.3	71.6	-93.6	0	0	0	112.7	P235 A239 Q240	P235-W237 PolarHBondContact O-N 3.17Å; W237-A239 VanDerWaalsContact C-N 3.35Å; W237-Q240 PolarHBondContact O-N 3.27Å
238	A	67.5	Low	57	Low	43 Å²	43	138.5 Å²	138.5	36%	0.355	69%	0.69	S	S	.	*	H	α-helix	trans	-70.4	-32.9	175.4	0	0	0	0	0	111.7	P234 P235 E236 Q240	P234-A238 HydrophobicContact CB-CB 4.5Å; P235-A238 WeakPolarHBondContact O-CB 3.2Å; P235-A238 PolarHBondContact O-N 3.32Å; E236-A238 PolarHBondContact O-N 3.47Å; A238-Q240 VanDerWaalsContact C-N 3.34Å
239	A	62	Low	56.8	Low	66 Å²	66	138 Å²	138	55%	0.545	70%	0.695	S	S	.	*	H	α-helix	trans	-72.5	-27	175.3	0	0	0	0	0	112.5	E236 W237 V241 S242	E236-A239 PolarHBondContact O-N 3.23Å; E236-A239 VanDerWaalsContact O-N 3.14Å; W237-A239 VanDerWaalsContact C-N 3.35Å; A239-V241 VanDerWaalsContact C-N 3.29Å; A239-V241 PolarHBondContact O-N 3.21Å; A239-S242 PolarHBondContact O-OG 3.15Å; A239-S242 VanDerWaalsContact O-OG 3.06Å
240	Q	59.5	Low	56.4	Low	146 Å²	146	138.5 Å²	138.5	68%	0.682	70%	0.702	S	S	*	*	H	α-helix	trans	-71.8	-22	178.9	-120.6	173.8	-34.9	0	0	113.5	E236 W237 A238	E236-Q240 PolarHBondContact O-N 3.14Å; W237-Q240 PolarHBondContact O-N 3.27Å; A238-Q240 VanDerWaalsContact C-N 3.34Å
241	V	57.7	Low	56.1	Low	98 Å²	98	139.1 Å²	139.1	59%	0.594	70%	0.699	S	S	*	*	H	α-helix	trans	-73.2	-35.7	178.2	-177.2	0	0	0	0	111.4	A239 K243 K244	A239-V241 VanDerWaalsContact C-N 3.29Å; A239-V241 PolarHBondContact O-N 3.21Å; V241-K243 VanDerWaalsContact C-N 3.33Å; V241-K243 PolarHBondContact O-N 3.21Å; V241-K244 PolarHBondContact O-N 3.1Å
242	S	57.3	Low	55.9	Low	99 Å²	99	135.9 Å²	135.9	69%	0.692	69%	0.693	S	S	*	*	H	α-helix	trans	-68.9	-30.3	-179.4	66.6	0	0	0	0	112.9	A239	A239-S242 PolarHBondContact O-OG 3.15Å; A239-S242 VanDerWaalsContact O-OG 3.06Å
243	K	54.5	Low	55.9	Low	185 Å²	185	133.5 Å²	133.5	80%	0.804	70%	0.695	S	S	*	*	H	α-helix	trans	-82.9	-18	-179.8	-148.5	170.1	-171.3	169.6	0	114.1	V241	V241-K243 VanDerWaalsContact C-N 3.33Å; V241-K243 PolarHBondContact O-N 3.21Å
244	K	49.3	Very low	55.8	Low	162 Å²	162	131.1 Å²	131.1	70%	0.704	69%	0.691	S	S	*	*	H	α-helix	trans	-91.2	-16.1	180	-147	177	-175.2	-179.9	0	113.3	V241 D246	V241-K244 PolarHBondContact O-N 3.1Å; K244-D246 VanDerWaalsContact C-N 3.29Å; K244-D246 PolarHBondContact O-N 3.41Å
245	G	49.5	Very low	55.4	Low	49 Å²	49	130.2 Å²	130.2	51%	0.505	69%	0.688	S	S	.	*	G	3₁₀ helix	trans	-64.2	-28.6	178.5	0	0	0	0	0	114.3
246	D	50.9	Low	54.9	Low	142 Å²	142	133 Å²	133	76%	0.759	70%	0.703	S	S	*	*	G	3₁₀ helix	trans	-86.9	-9.7	-171.7	-154.3	28.7	0	0	0	114.2	K244	K244-D246 VanDerWaalsContact C-N 3.29Å; K244-D246 PolarHBondContact O-N 3.41Å
247	R	46.9	Very low	54.3	Low	221 Å²	221	131.3 Å²	131.3	83%	0.834	70%	0.699	S	S	*	*	G	3₁₀ helix	trans	-94.9	-9.1	-178.5	-114.8	179.3	178.6	167.7	-0.9	114.8
248	L	51.7	Low	52.8	Low	132 Å²	132	126.9 Å²	126.9	69%	0.691	70%	0.702	S	S	*	*	S	Bend	trans	-93.9	-8.1	-175.8	-67.2	-178	0	0	0	114.3
249	L	53.5	Low	51.8	Low	152 Å²	152	137.5 Å²	137.5	80%	0.796	74%	0.744	S	S	*	*	S	Bend	trans	-90.3	-3.6	-178.5	-68.8	176.6	0	0	0	114.7
250	N	47.6	Very low	51.3	Low	154 Å²	154	141.1 Å²	141.1	82%	0.824	75%	0.753	S	S	*	*			trans	-123.9	59.1	-180	-126.3	46.2	0	0	0	111.2
251	R	49.4	Very low	50.8	Low	197 Å²	197	140.8 Å²	140.8	74%	0.743	76%	0.757	S	S	*	*			trans	-101.2	112.7	162.1	-72.6	-174.2	77.5	-164.2	1.8	107.9	S253	R251-S253 PolarHBondContact O-N 3.04Å
252	P	52.5	Low	50.4	Low	107 Å²	107	143.2 Å²	143.2	70%	0.695	77%	0.766	S	S	*	*			trans	-54.4	137.9	171.9	-22.1	32.8	0	0	0	109.8	D254	P252-D254 PolarHBondContact O-N 3.24Å
253	S	54.5	Low	50	Low	118 Å²	118	145.8 Å²	145.8	83%	0.825	77%	0.771	S	S	*	*			trans	-61.6	101.3	173.9	55.4	0	0	0	0	109.2	R251 S255	R251-S253 PolarHBondContact O-N 3.04Å; S253-S255 VanDerWaalsContact C-N 3.33Å; S253-S255 PolarHBondContact O-N 3.34Å
254	D	54.3	Low	49.8	Very low	134 Å²	134	143.4 Å²	143.4	72%	0.717	77%	0.768	S	S	*	*			trans	-68.1	96.4	171.3	-71.6	-37.4	0	0	0	108	P252 V256	P252-D254 PolarHBondContact O-N 3.24Å; D254-V256 PolarHBondContact O-N 3.34Å; D254-V256 VanDerWaalsContact O-N 3.14Å
255	S	48.7	Very low	49.8	Very low	91 Å²	91	142.1 Å²	142.1	64%	0.636	77%	0.773	S	S	*	*			trans	-54.4	108.9	161.3	179.9	0	0	0	0	107.3	S253 D257	S253-S255 VanDerWaalsContact C-N 3.33Å; S253-S255 PolarHBondContact O-N 3.34Å; S255-D257 VanDerWaalsContact C-N 3.26Å; S255-D257 PolarHBondContact O-N 2.93Å; S255-D257 PolarHBondContact OG-OD1 3.1Å
256	V	54.3	Low	49.8	Very low	139 Å²	139	148.8 Å²	148.8	84%	0.842	79%	0.792	S	S	*	*			trans	-74.7	91.9	169	175.9	0	0	0	0	105.9	D254 A258	D254-V256 PolarHBondContact O-N 3.34Å; D254-V256 VanDerWaalsContact O-N 3.14Å; V256-A258 PolarHBondContact O-N 2.83Å
257	D	48.3	Very low	49.7	Very low	139 Å²	139	149.3 Å²	149.3	74%	0.743	79%	0.794	S	S	*	*			trans	-59.2	119.2	174.7	-73.9	-30.4	0	0	0	109.4	S255 H259	S255-D257 VanDerWaalsContact C-N 3.26Å; S255-D257 PolarHBondContact O-N 2.93Å; S255-D257 PolarHBondContact OG-OD1 3.1Å; D257-H259 PolarHBondContact O-N 3.26Å
258	A	39.2	Very low	50	Low	90 Å²	90	143.3 Å²	143.3	74%	0.744	79%	0.791	S	S	*	*			trans	-87.4	96.5	177.4	0	0	0	0	0	109.3	V256	V256-A258 PolarHBondContact O-N 2.83Å
259	H	45.5	Very low	49.8	Very low	267 Å²	267	144.4 Å²	144.4	100%	1.236	80%	0.8	S	S	*	*			trans	-140.6	0	159.8	-82.6	-13.1	0	0	0	110.2	D257	D257-H259 PolarHBondContact O-N 3.26Å

Retrieved 259 of 259 residues in 159.3 ms (Link to these results)

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