A0A096NUB1_PAPAN Loading...

Spindle and centriole-associated protein 1

AlphaFold DB , UniProt , Accession A0A096NUB1, Species PAPAN (Papio anubis, Olive baboon), Gene SPICE1, Length 858 aa.

						>A0A096NUB1_PAPAN|A0A096NUB1|SPICE1
MSFVRVNRCGPRVGVRKTPKVKKKKTSVKQEWDNTVTDLTVHRATPEDLVRRHEIHKSKNRALVHWELQEKALKRKWRKQKPETLNLEKRRLSIMKEILSDQYQMQDVLEKSDHLIAAAKELFPHRRTGFPNITVAPDSSQGPIVVNQDPVTQSVFNESVIEPQALNYVDGEEEGTINSQSGESESENENDLDNSLNSQSNTNTDRFLQQLTEENSELISKLWTDIQQKIATQSQVTPPGTPSPALSSGEQRAALNATNAVKRLQTRLQPEESTETLDSSYVVGHVLNSRKQKQLLNKVKRKPNLHALSKPKKNMLSGSTTSADLPNRTNSNLDVLKHMIHEVEHEMEEYERWTGREVKGLQSSQGLTGFTLSLVSSLCRLVRYLKESEIQLRKEVETRQQLEQVLGDHRELIDALTAEILRLREENATTQARLQQYMVTTDEQLISLTHAIKNCPVINNRQEIQASERGATGRRNMDSSEGPAVNANVSVPLMFREEEVVEFPQEELPVKLSQVPDPPDNMTLAKNFPAHIFEPAVLLTPPRQKSNLKFSPLQDVLRRTVQTRPAPRLPPTVEIIEKEQNWEEKTLPVDTDIQNSSEENRLFTQRWRVSHMGEDLENKTQAPFVNLSQPLCNSHSNTQQSRSPTFSEELPVLGDGQQLRTNEALIQRKDIMARIADLTLQNSAMKAHTNSIIEPRGEQGDGFRELNKQESASDMTSTFPIAQSLAPGSMEERIAELNRQSMEARGKLLQLIEQQKLVGLNLSPPMLPVQLPLRAWTEGAKRTIEVSIPGAEASESSKCSTVSPVSGINTRRSSGATSNSCSPLNATSGSGRFTPLNPRAKIEKQNEEGWFALSTHVS
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

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	38.4	Very low	33.5	Very low	256 Å²	256	159.5 Å²	159.5	100%	1.261	85%	0.849	S	S	*	*				0	149.9	0	-57.8	-177.1	-161.4	0	0	108.4
2	S	32.9	Very low	33.5	Very low	97 Å²	97	167.1 Å²	167.1	68%	0.678	86%	0.857	S	S	*	*			trans	-99.4	149.7	173.9	48.9	0	0	0	0	110.9
3	F	31.8	Very low	33.4	Very low	208 Å²	208	164.6 Å²	164.6	91%	0.912	85%	0.854	S	S	*	*			trans	-160	142.2	135.1	-95	-56.7	0	0	0	111.6
4	V	35.4	Very low	33.4	Very low	117 Å²	117	157.9 Å²	157.9	71%	0.709	85%	0.845	S	S	*	*			trans	-117.3	136.1	-173.8	166.2	0	0	0	0	109.8	V6	V4-V6 HydrophobicContact CG1-CG2 3.61Å
5	R	38	Very low	33.6	Very low	238 Å²	238	155.3 Å²	155.3	90%	0.898	84%	0.837	S	S	*	*			trans	-145.8	99.5	161.7	-83.3	-177.4	-86.6	-128.6	-2.1	106.6
6	V	31.7	Very low	33.9	Very low	117 Å²	117	160.8 Å²	160.8	71%	0.709	84%	0.842	S	S	*	*				63.1	107.4	55.8	171.8	0	0	0	0	113.4	V4	V4-V6 HydrophobicContact CG1-CG2 3.61Å
7	N	30.4	Very low	34.2	Very low	153 Å²	153	162.8 Å²	162.8	82%	0.818	84%	0.842	S	S	*	*			trans	-73.3	146.2	170.4	-63.5	-31.3	0	0	0	111.7
8	R	30.1	Very low	34.3	Very low	237 Å²	237	161.6 Å²	161.6	89%	0.894	84%	0.843	S	S	*	*			trans	-179.1	126.2	142.9	-101.6	158.4	-157.1	-125.2	5.2	110.5
9	C	28.9	Very low	34.7	Very low	137 Å²	137	159.3 Å²	159.3	93%	0.926	84%	0.839	S	S	*	*				162.8	121.5	129.6	-90.6	0	0	0	0	112.7
10	G	28.8	Very low	35.1	Very low	71 Å²	71	161.9 Å²	161.9	73%	0.732	84%	0.843	S	S	*	*			trans	-136.1	-167.1	144	0	0	0	0	0	107.2
11	P	42.1	Very low	35.5	Very low	123 Å²	123	160.8 Å²	160.8	80%	0.799	84%	0.843	S	S	*	*			cis	-118	179.3	-16.9	39.7	-27.6	0	0	0	111.3
12	R	32.9	Very low	35.6	Very low	251 Å²	251	158 Å²	158	95%	0.947	82%	0.824	S	S	*	*			trans	-142.6	127.2	158.6	-109.8	-176.9	-166.7	-108	1.4	112.8
13	V	32.9	Very low	36.1	Very low	135 Å²	135	163.4 Å²	163.4	82%	0.818	84%	0.836	S	S	*	*			trans	-79.9	140.3	175.8	176.5	0	0	0	0	110.1	V15	V13-V15 HydrophobicContact CG1-CG2 4.15Å
14	G	32.8	Very low	36.7	Very low	71 Å²	71	163.2 Å²	163.2	73%	0.732	83%	0.834	S	S	*	*			trans	-140.2	60.9	-174.1	0	0	0	0	0	114.5	R16	G14-R16 PolarHBondContact O-N 3.5Å
15	V	36.4	Very low	37.1	Very low	118 Å²	118	167.6 Å²	167.6	72%	0.715	84%	0.844	S	S	*	*			trans	-67.7	128.9	175.9	179	0	0	0	0	110.9	V13	V13-V15 HydrophobicContact CG1-CG2 4.15Å
16	R	38.9	Very low	37.3	Very low	243 Å²	243	163.2 Å²	163.2	92%	0.917	84%	0.844	S	S	*	*			trans	-133.2	131.1	164.9	-65.2	-168.1	-176	-159.8	3	110.9	G14	G14-R16 PolarHBondContact O-N 3.5Å
17	K	38.4	Very low	37.9	Very low	196 Å²	196	162.8 Å²	162.8	85%	0.852	85%	0.846	S	S	*	*	P	Polyproline II helix	trans	-98.4	152.9	175.7	-64.3	178.2	179.5	177.7	0	109.9
18	T	36.7	Very low	38.6	Very low	140 Å²	140	162.2 Å²	162.2	86%	0.859	85%	0.847	S	S	*	*	P	Polyproline II helix	trans	-86.4	135.6	-177.9	45.5	0	0	0	0	112.9
19	P	42.3	Very low	39.7	Very low	119 Å²	119	160.3 Å²	160.3	77%	0.773	85%	0.846	S	S	*	*	P	Polyproline II helix	trans	-87	145.2	171.7	33.6	-32.7	0	0	0	112.1
20	K	41.3	Very low	40.8	Very low	210 Å²	210	162.3 Å²	162.3	91%	0.913	84%	0.841	S	S	*	*	P	Polyproline II helix	trans	-93	132.7	174.5	-62.7	179.6	-179	179.2	0	110.5
21	V	44.4	Very low	41.9	Very low	140 Å²	140	167.9 Å²	167.9	85%	0.848	85%	0.848	S	S	*	*			trans	-107.3	134.7	175	-178.9	0	0	0	0	110.6
22	K	40.2	Very low	42.7	Very low	198 Å²	198	172.5 Å²	172.5	86%	0.861	85%	0.85	S	S	*	*	P	Polyproline II helix	trans	-89.4	138.4	178.2	-62.8	-178.9	179.8	-179.8	0	110.7
23	K	43.4	Very low	43.3	Very low	210 Å²	210	167.2 Å²	167.2	91%	0.913	84%	0.841	S	S	*	*	P	Polyproline II helix	trans	-74.4	137.2	171.2	-66.7	-173	177.2	-174.6	0	110.9
24	K	43.9	Very low	44.4	Very low	204 Å²	204	168.8 Å²	168.8	89%	0.887	85%	0.845	S	S	*	*	P	Polyproline II helix	trans	-96.3	154.8	159.7	-73.7	-175	175.2	-177.7	0	109.4
25	K	45.4	Very low	45.8	Very low	209 Å²	209	171 Å²	171	91%	0.909	84%	0.844	S	S	*	*	P	Polyproline II helix	trans	-89.2	155.1	168.2	-69.1	-176.6	176.1	-176.8	0	110
26	T	41	Very low	46.8	Very low	146 Å²	146	171.5 Å²	171.5	90%	0.896	85%	0.847	S	S	*	*			trans	-118	160.7	170.2	-6.7	0	0	0	0	110.1
27	S	44.6	Very low	47.6	Very low	107 Å²	107	165.5 Å²	165.5	75%	0.748	84%	0.838	S	S	*	*	P	Polyproline II helix	trans	-90.2	161.2	-161.6	53.5	0	0	0	0	115.2
28	V	45.3	Very low	48.5	Very low	141 Å²	141	161.3 Å²	161.3	86%	0.855	82%	0.824	S	S	*	*	P	Polyproline II helix	trans	-54.2	143.8	161.8	178.5	0	0	0	0	109.5
29	K	52.8	Low	49.6	Very low	198 Å²	198	160.1 Å²	160.1	86%	0.861	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-101.1	141.7	167.4	-82.1	-167.4	171.8	-171.7	0	110.2
30	Q	51.8	Low	50.4	Low	179 Å²	179	158.1 Å²	158.1	84%	0.836	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-84.9	141.3	-177.7	-175.4	173	-13.4	0	0	110.4
31	E	52.8	Low	51.3	Low	188 Å²	188	153.7 Å²	153.7	88%	0.879	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-74.3	146	174.9	-68.8	163.1	-175.6	0	0	110
32	W	57.9	Low	52	Low	219 Å²	219	154.7 Å²	154.7	83%	0.83	78%	0.783	S	S	*	*			trans	-132	152.8	179.1	49.8	-90	0	0	0	109.4	N34	W32-N34 PolarHBondContact O-N 3.46Å
33	D	45.4	Very low	53.5	Low	141 Å²	141	154.3 Å²	154.3	75%	0.754	78%	0.776	S	S	*	*			trans	-62.8	130.3	-152.2	-64.1	-77.3	0	0	0	116.2	T35	D33-T35 VanDerWaalsContact C-N 3.35Å; D33-T35 PolarHBondContact O-N 3.12Å
34	N	56.9	Low	54.9	Low	168 Å²	168	145.5 Å²	145.5	90%	0.898	74%	0.743	S	S	*	*			trans	-79.4	73.6	175.2	-71.5	-54.8	0	0	0	111.4	W32	W32-N34 PolarHBondContact O-N 3.46Å
35	T	60.9	Low	56.6	Low	117 Å²	117	139.1 Å²	139.1	72%	0.718	72%	0.721	S	S	*	*			trans	-134.7	141	170.3	55.6	0	0	0	0	113.4	D33	D33-T35 VanDerWaalsContact C-N 3.35Å; D33-T35 PolarHBondContact O-N 3.12Å
36	V	58.4	Low	58.2	Low	128 Å²	128	133.3 Å²	133.3	78%	0.776	71%	0.705	S	S	*	*	S	Bend	trans	72.4	119	179.2	-167.4	0	0	0	0	115.3
37	T	55.2	Low	60	Low	118 Å²	118	131.6 Å²	131.6	72%	0.724	69%	0.687	S	S	*	*			trans	52.6	91.1	-179.6	35.7	0	0	0	0	115	L39	T37-L39 PolarHBondContact O-N 3.15Å
38	D	57.9	Low	61.8	Low	107 Å²	107	128.5 Å²	128.5	57%	0.572	66%	0.661	S	S	*	*			trans	-66.6	96.8	170.1	-175	-0.9	0	0	0	111.2	T40 V41	D38-T40 PolarHBondContact O-N 3.19Å; D38-T40 VanDerWaalsContact O-N 3.14Å; D38-T40 WeakPolarHBondContact OD1-CB 3.22Å; D38-T40 WeakPolarHBondContact OD1-CG2 3.42Å; D38-T40 PolarHBondContact OD1-N 3.49Å; D38-T40 PolarHBondContact OD1-OG1 3.05Å; D38-T40 PolarHBondContact OD2-OG1 3.22Å; D38-V41 PolarHBondContact O-N 3.31Å
39	L	60.4	Low	63.7	Low	115 Å²	115	125.6 Å²	125.6	60%	0.602	64%	0.641	S	S	*	*	G	3₁₀ helix	trans	-68.4	-1.9	176.4	-68.5	175.2	0	0	0	113.4	T37 V41 H42 R43	T37-L39 PolarHBondContact O-N 3.15Å; L39-V41 PolarHBondContact O-N 2.56Å; L39-H42 CarbonylContact O-C 3.59Å; L39-H42 PolarHBondContact O-N 2.97Å; L39-R43 PolarHBondContact O-N 3.09Å
40	T	59.4	Low	65.1	Low	78 Å²	78	120.3 Å²	120.3	48%	0.479	63%	0.625	S	S	.	*	G	3₁₀ helix	trans	-63.4	-26.3	170.6	68.5	0	0	0	0	112.4	D38 H42 R43	D38-T40 PolarHBondContact O-N 3.19Å; D38-T40 VanDerWaalsContact O-N 3.14Å; D38-T40 WeakPolarHBondContact OD1-CB 3.22Å; D38-T40 WeakPolarHBondContact OD1-CG2 3.42Å; D38-T40 PolarHBondContact OD1-N 3.49Å; D38-T40 PolarHBondContact OD1-OG1 3.05Å; D38-T40 PolarHBondContact OD2-OG1 3.22Å; T40-H42 PolarHBondContact O-N 3.45Å; T40-H42 VanDerWaalsContact O-N 3.15Å; T40-R43 PolarHBondContact O-N 2.95Å
41	V	59.6	Low	66.4	Low	117 Å²	117	118.1 Å²	118.1	71%	0.709	61%	0.609	S	S	*	*	G	3₁₀ helix	trans	-61.5	-21.3	171.3	-173	0	0	0	0	112.3	D38 L39	D38-V41 PolarHBondContact O-N 3.31Å; L39-V41 PolarHBondContact O-N 2.56Å
42	H	58.8	Low	68	Low	160 Å²	160	115.5 Å²	115.5	74%	0.741	59%	0.591	S	S	*	*	G	3₁₀ helix	trans	-108.9	-3	173.2	-63.3	-41	0	0	0	113.8	L39 T40	L39-H42 CarbonylContact O-C 3.59Å; L39-H42 PolarHBondContact O-N 2.97Å; T40-H42 PolarHBondContact O-N 3.45Å; T40-H42 VanDerWaalsContact O-N 3.15Å
43	R	72.2	Confident	69.1	Low	190 Å²	190	110.1 Å²	110.1	72%	0.717	58%	0.575	S	S	*	*	S	Bend	trans	-74	132.9	165.1	-70	-174.3	-178.3	-142.3	1.3	107.6	L39 T40 T45	L39-R43 PolarHBondContact O-N 3.09Å; T40-R43 PolarHBondContact O-N 2.95Å; R43-T45 PolarHBondContact O-N 3.09Å
44	A	71.9	Confident	70.8	Confident	25 Å²	25	108.5 Å²	108.5	21%	0.207	56%	0.563	C	S	.	*			trans	-59.6	124.5	170.6	0	0	0	0	0	108.9	D48 L49	A44-D48 HydrophobicContact CB-CB 4.13Å; A44-L49 HydrophobicContact CB-CD2 3.92Å; A44-L49 HydrophobicContact CB-CG 3.87Å
45	T	80.5	Confident	71.8	Confident	71 Å²	71	106.7 Å²	106.7	44%	0.436	55%	0.552	S	S	.	*			trans	-44.5	144.8	171.6	-11.8	0	0	0	0	109.9	R43 E47 D48 L49	R43-T45 PolarHBondContact O-N 3.09Å; T45-E47 WeakPolarHBondContact CG2-OE2 3.28Å; T45-E47 PolarHBondContact O-N 3.44Å; T45-D48 WeakPolarHBondContact CB-OD2 3.47Å; T45-D48 CarbonylContact O-C 3.51Å; T45-D48 WeakPolarHBondContact O-CA 3.28Å; T45-D48 WeakPolarHBondContact O-CB 3.4Å; T45-D48 PolarHBondContact O-N 3.31Å; T45-D48 PolarHBondContact OG1-OD2 3.48Å; T45-L49 PolarHBondContact O-N 3.19Å
46	P	79.1	Confident	72.5	Confident	87 Å²	87	108.6 Å²	108.6	57%	0.565	55%	0.552	S	S	*	*	H	α-helix	trans	-51	-35.8	176.6	-28.6	36.8	0	0	0	112.6	L49 V50	P46-L49 PolarHBondContact O-N 3.41Å; P46-V50 WeakPolarHBondContact O-CG2 3.32Å; P46-V50 PolarHBondContact O-N 2.98Å
47	E	78.4	Confident	73.4	Confident	110 Å²	110	106.7 Å²	106.7	51%	0.514	53%	0.533	S	S	.	.	H	α-helix	trans	-68.4	-33.8	175.7	-60.8	66.1	-143.6	0	0	112.3	T45 R51	T45-E47 WeakPolarHBondContact CG2-OE2 3.28Å; T45-E47 PolarHBondContact O-N 3.44Å; E47-R51 WeakPolarHBondContact O-CB 3.44Å; E47-R51 VanDerWaalsContact O-CG 3.27Å; E47-R51 WeakPolarHBondContact O-CG 3.46Å; E47-R51 PolarHBondContact O-N 3.05Å
48	D	81.9	Confident	74.3	Confident	41 Å²	41	104.7 Å²	104.7	22%	0.219	52%	0.524	C	S	.	.	H	α-helix	trans	-74.6	-35.5	172.3	-81.1	-65	0	0	0	112.8	A44 T45 R51 R52	A44-D48 HydrophobicContact CB-CB 4.13Å; T45-D48 WeakPolarHBondContact CB-OD2 3.47Å; T45-D48 CarbonylContact O-C 3.51Å; T45-D48 WeakPolarHBondContact O-CA 3.28Å; T45-D48 WeakPolarHBondContact O-CB 3.4Å; T45-D48 PolarHBondContact O-N 3.31Å; T45-D48 PolarHBondContact OG1-OD2 3.48Å; D48-R51 PolarHBondContact O-N 3.47Å; D48-R51 IonicContact OD1-CZ 3.37Å; D48-R51 VanDerWaalsContact OD1-CZ 3.3Å; D48-R51 IonicContact OD1-NE 3.73Å; D48-R51 PolarHBondContact OD1-NE 3.23Å; D48-R51 IonicContact OD1-NH2 3.2Å; D48-R51 PolarHBondContact OD1-NH2 3.46Å; D48-R51 IonicContact OD2-CZ 2.58Å; D48-R51 IonicContact OD2-NH2 2.74Å; D48-R51 PolarHBondContact OD2-NH2 2.85Å; D48-R52 WeakPolarHBondContact O-CB 3.18Å; D48-R52 WeakPolarHBondContact O-CG 3.38Å; D48-R52 PolarHBondContact O-N 3.28Å
49	L	85	Confident	75	Confident	81 Å²	81	109.4 Å²	109.4	42%	0.424	54%	0.54	S	S	.	.	H	α-helix	trans	-64.2	-45.1	170.9	-71.7	171	0	0	0	110.2	A44 T45 P46 R52 H53	A44-L49 HydrophobicContact CB-CD2 3.92Å; A44-L49 HydrophobicContact CB-CG 3.87Å; T45-L49 PolarHBondContact O-N 3.19Å; P46-L49 PolarHBondContact O-N 3.41Å; L49-R52 PolarHBondContact O-N 2.88Å; L49-H53 PolarHBondContact O-N 3.39Å; L49-H53 PolarHBondContact O-ND1 3.29Å
50	V	82.2	Confident	75.8	Confident	87 Å²	87	108.7 Å²	108.7	53%	0.527	54%	0.536	S	S	.	.	H	α-helix	trans	-62	-46.5	173.4	170.7	0	0	0	0	111	P46 R52 H53 E54	P46-V50 WeakPolarHBondContact O-CG2 3.32Å; P46-V50 PolarHBondContact O-N 2.98Å; V50-R52 VanDerWaalsContact C-N 3.34Å; V50-R52 PolarHBondContact O-N 2.95Å; V50-H53 CarbonylContact O-C 3.59Å; V50-H53 PolarHBondContact O-N 3.45Å; V50-E54 PolarHBondContact O-N 3.34Å
51	R	79.8	Confident	76.7	Confident	132 Å²	132	110.9 Å²	110.9	50%	0.498	54%	0.536	S	S	.	.	H	α-helix	trans	-55.7	-45.4	174.7	-81.2	-171.6	-71.5	-103.2	13.2	112.2	E47 D48 E54 I55	E47-R51 WeakPolarHBondContact O-CB 3.44Å; E47-R51 VanDerWaalsContact O-CG 3.27Å; E47-R51 WeakPolarHBondContact O-CG 3.46Å; E47-R51 PolarHBondContact O-N 3.05Å; D48-R51 PolarHBondContact O-N 3.47Å; D48-R51 IonicContact OD1-CZ 3.37Å; D48-R51 VanDerWaalsContact OD1-CZ 3.3Å; D48-R51 IonicContact OD1-NE 3.73Å; D48-R51 PolarHBondContact OD1-NE 3.23Å; D48-R51 IonicContact OD1-NH2 3.2Å; D48-R51 PolarHBondContact OD1-NH2 3.46Å; D48-R51 IonicContact OD2-CZ 2.58Å; D48-R51 IonicContact OD2-NH2 2.74Å; D48-R51 PolarHBondContact OD2-NH2 2.85Å; R51-E54 PolarHBondContact O-N 3.33Å; R51-I55 WeakPolarHBondContact O-CD1 3.33Å; R51-I55 VanDerWaalsContact O-CG1 3.25Å; R51-I55 WeakPolarHBondContact O-CG1 3.29Å; R51-I55 PolarHBondContact O-N 3.04Å
52	R	86.9	Confident	77.6	Confident	133 Å²	133	109 Å²	109	50%	0.502	53%	0.532	S	S	.	.	H	α-helix	trans	-64.9	-41.8	177.5	-70.6	168.5	-162.9	-172.1	5.5	111.6	D48 L49 V50 E54 I55 H56	D48-R52 WeakPolarHBondContact O-CB 3.18Å; D48-R52 WeakPolarHBondContact O-CG 3.38Å; D48-R52 PolarHBondContact O-N 3.28Å; L49-R52 PolarHBondContact O-N 2.88Å; V50-R52 VanDerWaalsContact C-N 3.34Å; V50-R52 PolarHBondContact O-N 2.95Å; R52-E54 VanDerWaalsContact C-N 3.33Å; R52-E54 PolarHBondContact O-N 3.03Å; R52-I55 PolarHBondContact O-N 3.38Å; R52-H56 WeakPolarHBondContact O-CB 3.43Å; R52-H56 PolarHBondContact O-CD2 2.91Å; R52-H56 PolarHBondContact O-N 3.49Å
53	H	80.7	Confident	78.7	Confident	106 Å²	106	106.3 Å²	106.3	49%	0.491	52%	0.523	S	S	.	.	H	α-helix	trans	-64.3	-36.8	172.7	-74.2	82.7	0	0	0	111.8	L49 V50 H56 K57	L49-H53 PolarHBondContact O-N 3.39Å; L49-H53 PolarHBondContact O-ND1 3.29Å; V50-H53 CarbonylContact O-C 3.59Å; V50-H53 PolarHBondContact O-N 3.45Å; H53-H56 CarbonylContact O-C 3.47Å; H53-H56 PolarHBondContact O-N 3.43Å; H53-K57 WeakPolarHBondContact O-CB 3.45Å; H53-K57 VanDerWaalsContact O-CG 3.23Å; H53-K57 WeakPolarHBondContact O-CG 3.16Å; H53-K57 PolarHBondContact O-N 2.88Å
54	E	80.5	Confident	79.2	Confident	108 Å²	108	100.9 Å²	100.9	51%	0.505	51%	0.511	S	S	.	.	H	α-helix	trans	-64.6	-40.9	174.8	-141.4	66.9	-126.7	0	0	112.5	V50 R51 R52 H56 K57	V50-E54 PolarHBondContact O-N 3.34Å; R51-E54 PolarHBondContact O-N 3.33Å; R52-E54 VanDerWaalsContact C-N 3.33Å; R52-E54 PolarHBondContact O-N 3.03Å; E54-H56 VanDerWaalsContact C-N 3.35Å; E54-K57 WeakPolarHBondContact OE1-CD 3.45Å; E54-K57 IonicContact OE1-NZ 2.69Å; E54-K57 PolarHBondContact OE1-NZ 2.92Å; E54-K57 IonicContact OE2-NZ 3.96Å; E54-K57 PolarHBondContact OE2-NZ 2.91Å
55	I	78.3	Confident	79.8	Confident	130 Å²	130	104.7 Å²	104.7	67%	0.667	52%	0.524	S	S	*	.	H	α-helix	trans	-67.2	-35.2	176.2	-68.8	161.9	0	0	0	111.5	R51 R52	R51-I55 WeakPolarHBondContact O-CD1 3.33Å; R51-I55 VanDerWaalsContact O-CG1 3.25Å; R51-I55 WeakPolarHBondContact O-CG1 3.29Å; R51-I55 PolarHBondContact O-N 3.04Å; R52-I55 PolarHBondContact O-N 3.38Å
56	H	76.3	Confident	79.8	Confident	156 Å²	156	109.1 Å²	109.1	72%	0.722	53%	0.533	S	S	*	.	H	α-helix	trans	-94.7	-6.3	-179.3	-64.1	-54.3	0	0	0	114.8	R52 H53 E54 S58	R52-H56 WeakPolarHBondContact O-CB 3.43Å; R52-H56 PolarHBondContact O-CD2 2.91Å; R52-H56 PolarHBondContact O-N 3.49Å; H53-H56 CarbonylContact O-C 3.47Å; H53-H56 PolarHBondContact O-N 3.43Å; E54-H56 VanDerWaalsContact C-N 3.35Å; H56-S58 PolarHBondContact O-N 3.49Å; H56-S58 VanDerWaalsContact O-N 3.15Å
57	K	76.2	Confident	80.2	Confident	88 Å²	88	108.7 Å²	108.7	38%	0.383	52%	0.523	S	S	.	.	S	Bend	trans	-61.7	115.6	167.3	-87.1	166.1	-164.5	169	0	108.4	H53 E54 K59	H53-K57 WeakPolarHBondContact O-CB 3.45Å; H53-K57 VanDerWaalsContact O-CG 3.23Å; H53-K57 WeakPolarHBondContact O-CG 3.16Å; H53-K57 PolarHBondContact O-N 2.88Å; E54-K57 WeakPolarHBondContact OE1-CD 3.45Å; E54-K57 IonicContact OE1-NZ 2.69Å; E54-K57 PolarHBondContact OE1-NZ 2.92Å; E54-K57 IonicContact OE2-NZ 3.96Å; E54-K57 PolarHBondContact OE2-NZ 2.91Å; K57-K59 PolarHBondContact O-N 3.35Å
58	S	73.9	Confident	80.8	Confident	76 Å²	76	108.4 Å²	108.4	53%	0.531	53%	0.525	S	S	.	.			trans	-61.4	125.6	175.9	58.8	0	0	0	0	109.9	H56 N60 R61	H56-S58 PolarHBondContact O-N 3.49Å; H56-S58 VanDerWaalsContact O-N 3.15Å; S58-N60 PolarHBondContact O-N 2.82Å; S58-R61 VanDerWaalsContact O-CB 3.25Å; S58-R61 WeakPolarHBondContact O-CB 3.33Å; S58-R61 PolarHBondContact O-N 3.03Å
59	K	73.1	Confident	81.1	Confident	207 Å²	207	111.9 Å²	111.9	90%	0.9	54%	0.54	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.5	-27.9	177	-63	179.6	-178.9	178.3	0	111.7	K57 R61	K57-K59 PolarHBondContact O-N 3.35Å; K59-R61 VanDerWaalsContact C-N 3.31Å; K59-R61 PolarHBondContact O-N 3.26Å
60	N	76.5	Confident	81.1	Confident	99 Å²	99	111.6 Å²	111.6	53%	0.529	54%	0.536	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.2	4.1	176.7	-60.9	-0.3	0	0	0	113.9	S58 A62 L63 V64	S58-N60 PolarHBondContact O-N 2.82Å; N60-A62 VanDerWaalsContact C-N 3.29Å; N60-A62 PolarHBondContact O-N 3.26Å; N60-L63 HydrophobicContact CB-CB 4.44Å; N60-L63 CarbonylContact O-C 3.57Å; N60-L63 WeakPolarHBondContact O-CA 3.46Å; N60-L63 WeakPolarHBondContact O-CB 3.27Å; N60-L63 PolarHBondContact O-N 3.35Å; N60-V64 HydrophobicContact CB-CG2 4.4Å; N60-V64 WeakPolarHBondContact O-CG2 3.36Å; N60-V64 PolarHBondContact O-N 3.2Å
61	R	79.4	Confident	81.4	Confident	124 Å²	124	111.9 Å²	111.9	47%	0.468	53%	0.53	S	S	.	.	H	α-helix	trans	-54.1	-43.3	-179.2	177.9	174.3	177.4	178.7	-0.9	112.5	S58 K59 H65	S58-R61 VanDerWaalsContact O-CB 3.25Å; S58-R61 WeakPolarHBondContact O-CB 3.33Å; S58-R61 PolarHBondContact O-N 3.03Å; K59-R61 VanDerWaalsContact C-N 3.31Å; K59-R61 PolarHBondContact O-N 3.26Å; R61-H65 PolarHBondContact NE-NE2 3.5Å; R61-H65 PolarHBondContact O-CD2 2.85Å; R61-H65 PolarHBondContact O-N 2.77Å
62	A	78.1	Confident	81.7	Confident	77 Å²	77	107.8 Å²	107.8	64%	0.636	53%	0.525	S	S	*	.	H	α-helix	trans	-64.5	-44.6	175.6	0	0	0	0	0	111.8	N60 V64 H65 W66	N60-A62 VanDerWaalsContact C-N 3.29Å; N60-A62 PolarHBondContact O-N 3.26Å; A62-V64 PolarHBondContact O-N 2.99Å; A62-H65 PolarHBondContact O-N 3.48Å; A62-W66 WeakPolarHBondContact O-CB 3.4Å; A62-W66 PolarHBondContact O-N 2.96Å
63	L	81.4	Confident	81.3	Confident	105 Å²	105	106 Å²	106	55%	0.55	53%	0.525	S	S	.	.	H	α-helix	trans	-63.2	-40.7	177.7	-177.1	62.3	0	0	0	112.2	N60 W66 E67	N60-L63 HydrophobicContact CB-CB 4.44Å; N60-L63 CarbonylContact O-C 3.57Å; N60-L63 WeakPolarHBondContact O-CA 3.46Å; N60-L63 WeakPolarHBondContact O-CB 3.27Å; N60-L63 PolarHBondContact O-N 3.35Å; L63-W66 PolarHBondContact O-N 3.15Å; L63-E67 VanDerWaalsContact O-CB 3.23Å; L63-E67 WeakPolarHBondContact O-CB 3.49Å; L63-E67 PolarHBondContact O-N 2.63Å
64	V	83.5	Confident	81.1	Confident	75 Å²	75	106.2 Å²	106.2	46%	0.455	53%	0.525	S	S	.	.	H	α-helix	trans	-71	-37.4	177.6	172.1	0	0	0	0	111.6	N60 A62 L68	N60-V64 HydrophobicContact CB-CG2 4.4Å; N60-V64 WeakPolarHBondContact O-CG2 3.36Å; N60-V64 PolarHBondContact O-N 3.2Å; A62-V64 PolarHBondContact O-N 2.99Å; V64-L68 WeakPolarHBondContact O-CB 3.43Å; V64-L68 PolarHBondContact O-N 3.5Å
65	H	84.9	Confident	81.1	Confident	105 Å²	105	108.5 Å²	108.5	49%	0.486	53%	0.529	S	S	.	.	H	α-helix	trans	-64.2	-42.4	170.8	-77.6	-57.9	0	0	0	111.5	R61 A62 L68 Q69	R61-H65 PolarHBondContact NE-NE2 3.5Å; R61-H65 PolarHBondContact O-CD2 2.85Å; R61-H65 PolarHBondContact O-N 2.77Å; A62-H65 PolarHBondContact O-N 3.48Å; H65-L68 PolarHBondContact O-N 3.45Å; H65-Q69 VanDerWaalsContact O-CB 3.31Å; H65-Q69 WeakPolarHBondContact O-CB 3.48Å; H65-Q69 PolarHBondContact O-N 3.01Å
66	W	78.7	Confident	80.9	Confident	165 Å²	165	109.1 Å²	109.1	63%	0.625	53%	0.526	S	S	*	.	H	α-helix	trans	-63.4	-48.2	175.5	179.3	-110	0	0	0	112.2	A62 L63 L68 Q69 E70	A62-W66 WeakPolarHBondContact O-CB 3.4Å; A62-W66 PolarHBondContact O-N 2.96Å; L63-W66 PolarHBondContact O-N 3.15Å; W66-L68 VanDerWaalsContact C-N 3.33Å; W66-L68 PolarHBondContact O-N 3.49Å; W66-Q69 CarbonylContact O-C 3.57Å; W66-Q69 WeakPolarHBondContact O-CB 3.43Å; W66-Q69 PolarHBondContact O-N 3.31Å; W66-E70 WeakPolarHBondContact O-CB 3.12Å; W66-E70 PolarHBondContact O-N 3.35Å
67	E	89.6	Confident	80.1	Confident	77 Å²	77	108.6 Å²	108.6	36%	0.36	52%	0.518	S	S	.	.	H	α-helix	trans	-62.5	-38.2	176.6	-168.4	-159	165.7	0	0	111.7	L63 E70 K71	L63-E67 VanDerWaalsContact O-CB 3.23Å; L63-E67 WeakPolarHBondContact O-CB 3.49Å; L63-E67 PolarHBondContact O-N 2.63Å; E67-E70 PolarHBondContact O-N 3.48Å; E67-K71 HydrophobicContact CG-CD 4.17Å; E67-K71 WeakPolarHBondContact O-CB 3.49Å; E67-K71 VanDerWaalsContact O-CG 3.28Å; E67-K71 WeakPolarHBondContact O-CG 3.32Å; E67-K71 PolarHBondContact O-N 3.2Å; E67-K71 WeakPolarHBondContact OE1-CE 3.48Å; E67-K71 IonicContact OE1-NZ 3.11Å; E67-K71 PolarHBondContact OE1-NZ 3.03Å
68	L	90.9	Very high	79.8	Confident	105 Å²	105	112.6 Å²	112.6	55%	0.55	53%	0.531	S	S	.	.	H	α-helix	trans	-68	-39.6	174.6	-177.6	61.5	0	0	0	111.7	V64 H65 W66 A72	V64-L68 WeakPolarHBondContact O-CB 3.43Å; V64-L68 PolarHBondContact O-N 3.5Å; H65-L68 PolarHBondContact O-N 3.45Å; W66-L68 VanDerWaalsContact C-N 3.33Å; W66-L68 PolarHBondContact O-N 3.49Å; L68-A72 WeakPolarHBondContact O-CB 3.49Å; L68-A72 PolarHBondContact O-N 3.44Å
69	Q	86.6	Confident	79.6	Confident	114 Å²	114	117.2 Å²	117.2	53%	0.533	54%	0.541	S	S	.	.	H	α-helix	trans	-65.9	-41.4	174	-178	173.8	-5.8	0	0	111.3	H65 W66 A72 L73	H65-Q69 VanDerWaalsContact O-CB 3.31Å; H65-Q69 WeakPolarHBondContact O-CB 3.48Å; H65-Q69 PolarHBondContact O-N 3.01Å; W66-Q69 CarbonylContact O-C 3.57Å; W66-Q69 WeakPolarHBondContact O-CB 3.43Å; W66-Q69 PolarHBondContact O-N 3.31Å; Q69-A72 WeakPolarHBondContact O-CB 3.3Å; Q69-A72 PolarHBondContact O-N 3.43Å; Q69-L73 PolarHBondContact O-N 2.84Å
70	E	86.4	Confident	79	Confident	74 Å²	74	114.8 Å²	114.8	35%	0.346	53%	0.533	S	S	.	.	H	α-helix	trans	-68.1	-44	176.8	-162.3	-132.7	-154.2	0	0	111.3	W66 E67 A72 L73 K74	W66-E70 WeakPolarHBondContact O-CB 3.12Å; W66-E70 PolarHBondContact O-N 3.35Å; E67-E70 PolarHBondContact O-N 3.48Å; E70-A72 VanDerWaalsContact C-N 3.29Å; E70-A72 PolarHBondContact O-N 3.42Å; E70-L73 CarbonylContact O-C 3.58Å; E70-L73 PolarHBondContact O-N 3.18Å; E70-K74 HydrophobicContact CG-CD 4.47Å; E70-K74 WeakPolarHBondContact O-CB 3.32Å; E70-K74 WeakPolarHBondContact O-CG 3.44Å; E70-K74 PolarHBondContact O-N 2.8Å; E70-K74 WeakPolarHBondContact OE1-CE 3.4Å; E70-K74 IonicContact OE1-NZ 2.91Å; E70-K74 PolarHBondContact OE1-NZ 2.91Å; E70-K74 VanDerWaalsContact OE2-CE 3.28Å; E70-K74 WeakPolarHBondContact OE2-CE 3.28Å; E70-K74 IonicContact OE2-NZ 3.3Å; E70-K74 PolarHBondContact OE2-NZ 2.82Å
71	K	88.6	Confident	78	Confident	93 Å²	93	113.3 Å²	113.3	40%	0.404	52%	0.522	S	S	.	.	H	α-helix	trans	-65.7	-29.4	171.7	-75.2	175.6	170.3	175.6	0	112.3	E67 R75	E67-K71 HydrophobicContact CG-CD 4.17Å; E67-K71 WeakPolarHBondContact O-CB 3.49Å; E67-K71 VanDerWaalsContact O-CG 3.28Å; E67-K71 WeakPolarHBondContact O-CG 3.32Å; E67-K71 PolarHBondContact O-N 3.2Å; E67-K71 WeakPolarHBondContact OE1-CE 3.48Å; E67-K71 IonicContact OE1-NZ 3.11Å; E67-K71 PolarHBondContact OE1-NZ 3.03Å; K71-R75 WeakPolarHBondContact O-CB 3.18Å; K71-R75 WeakPolarHBondContact O-CG 3.27Å; K71-R75 PolarHBondContact O-N 3.26Å; K71-R75 VanDerWaalsContact O-N 3.12Å
72	A	85.6	Confident	77.1	Confident	46 Å²	46	111 Å²	111	38%	0.38	52%	0.523	S	S	.	.	H	α-helix	trans	-70.8	-43.6	170.8	0	0	0	0	0	111.3	L68 Q69 E70 R75 K76	L68-A72 WeakPolarHBondContact O-CB 3.49Å; L68-A72 PolarHBondContact O-N 3.44Å; Q69-A72 WeakPolarHBondContact O-CB 3.3Å; Q69-A72 PolarHBondContact O-N 3.43Å; E70-A72 VanDerWaalsContact C-N 3.29Å; E70-A72 PolarHBondContact O-N 3.42Å; A72-R75 PolarHBondContact O-N 3.29Å; A72-K76 WeakPolarHBondContact O-CG 3.36Å; A72-K76 PolarHBondContact O-N 2.75Å
73	L	78.2	Confident	75.9	Confident	96 Å²	96	115.1 Å²	115.1	50%	0.503	53%	0.529	S	S	.	.	H	α-helix	trans	-60	-54.2	172.9	-120.6	75.3	0	0	0	110.7	Q69 E70 R75 K76 W77	Q69-L73 PolarHBondContact O-N 2.84Å; E70-L73 CarbonylContact O-C 3.58Å; E70-L73 PolarHBondContact O-N 3.18Å; L73-R75 PolarHBondContact O-N 3.46Å; L73-R75 VanDerWaalsContact O-N 3.17Å; L73-K76 CarbonylContact O-C 3.55Å; L73-K76 WeakPolarHBondContact O-CA 3.31Å; L73-K76 WeakPolarHBondContact O-CB 3.49Å; L73-K76 PolarHBondContact O-N 3.24Å; L73-W77 PolarHBondContact O-N 2.87Å
74	K	77.3	Confident	74.8	Confident	111 Å²	111	112.5 Å²	112.5	48%	0.483	52%	0.517	S	S	.	.	H	α-helix	trans	-53.4	-38.9	177.1	-74.7	173.3	176.5	167.7	0	111.8	E70 R78	E70-K74 HydrophobicContact CG-CD 4.47Å; E70-K74 WeakPolarHBondContact O-CB 3.32Å; E70-K74 WeakPolarHBondContact O-CG 3.44Å; E70-K74 PolarHBondContact O-N 2.8Å; E70-K74 WeakPolarHBondContact OE1-CE 3.4Å; E70-K74 IonicContact OE1-NZ 2.91Å; E70-K74 PolarHBondContact OE1-NZ 2.91Å; E70-K74 VanDerWaalsContact OE2-CE 3.28Å; E70-K74 WeakPolarHBondContact OE2-CE 3.28Å; E70-K74 IonicContact OE2-NZ 3.3Å; E70-K74 PolarHBondContact OE2-NZ 2.82Å; K74-R78 VanDerWaalsContact O-CB 3.27Å; K74-R78 WeakPolarHBondContact O-CB 3.42Å; K74-R78 WeakPolarHBondContact O-CG 3.39Å; K74-R78 PolarHBondContact O-N 3.2Å
75	R	79.5	Confident	73.8	Confident	156 Å²	156	111 Å²	111	59%	0.589	51%	0.506	S	S	*	.	H	α-helix	trans	-70.5	-30.5	173	-74	175.3	-174.4	121.3	-8.3	114.4	K71 A72 L73 K79	K71-R75 WeakPolarHBondContact O-CB 3.18Å; K71-R75 WeakPolarHBondContact O-CG 3.27Å; K71-R75 PolarHBondContact O-N 3.26Å; K71-R75 VanDerWaalsContact O-N 3.12Å; A72-R75 PolarHBondContact O-N 3.29Å; L73-R75 PolarHBondContact O-N 3.46Å; L73-R75 VanDerWaalsContact O-N 3.17Å; R75-K79 VanDerWaalsContact O-CG 3.27Å; R75-K79 WeakPolarHBondContact O-CG 3.25Å; R75-K79 PolarHBondContact O-N 2.98Å
76	K	74.4	Confident	73	Confident	143 Å²	143	110.5 Å²	110.5	62%	0.622	51%	0.507	S	S	*	.	H	α-helix	trans	-73	-47.2	172.3	-70.2	-79.4	-174.9	167.6	0	111	A72 L73 K79 Q80	A72-K76 WeakPolarHBondContact O-CG 3.36Å; A72-K76 PolarHBondContact O-N 2.75Å; L73-K76 CarbonylContact O-C 3.55Å; L73-K76 WeakPolarHBondContact O-CA 3.31Å; L73-K76 WeakPolarHBondContact O-CB 3.49Å; L73-K76 PolarHBondContact O-N 3.24Å; K76-K79 CarbonylContact O-C 3.58Å; K76-K79 WeakPolarHBondContact O-CA 3.45Å; K76-K79 WeakPolarHBondContact O-CB 3.42Å; K76-K79 PolarHBondContact O-N 2.87Å; K76-Q80 PolarHBondContact O-N 3.47Å
77	W	60.6	Low	72.6	Confident	145 Å²	145	108.3 Å²	108.3	55%	0.549	51%	0.508	S	S	.	.	H	α-helix	trans	-60.5	-46.4	176.4	-79.3	68.1	0	0	0	111.9	L73 K79 Q80 K81	L73-W77 PolarHBondContact O-N 2.87Å; W77-K79 PolarHBondContact O-N 3.48Å; W77-K79 VanDerWaalsContact O-N 3.15Å; W77-Q80 PolarHBondContact O-N 3.29Å; W77-Q80 VanDerWaalsContact O-N 3.13Å; W77-K81 HydrophobicContact CE3-CD 3.95Å; W77-K81 HydrophobicContact CZ3-CD 4.2Å; W77-K81 PolarHBondContact O-N 3.18Å
78	R	69.3	Low	72	Confident	172 Å²	172	108.4 Å²	108.4	65%	0.649	51%	0.508	S	S	*	.	H	α-helix	trans	-57.8	-25.6	171.8	-72.6	-82.1	-166.7	-130.9	0.3	113.5	K74	K74-R78 VanDerWaalsContact O-CB 3.27Å; K74-R78 WeakPolarHBondContact O-CB 3.42Å; K74-R78 WeakPolarHBondContact O-CG 3.39Å; K74-R78 PolarHBondContact O-N 3.2Å
79	K	69.1	Low	71.4	Confident	173 Å²	173	110.1 Å²	110.1	75%	0.752	51%	0.511	S	S	*	.	H	α-helix	trans	-92.5	-20.1	177.3	-72.9	-178.5	178.9	-164.2	0	114.1	R75 K76 W77	R75-K79 VanDerWaalsContact O-CG 3.27Å; R75-K79 WeakPolarHBondContact O-CG 3.25Å; R75-K79 PolarHBondContact O-N 2.98Å; K76-K79 CarbonylContact O-C 3.58Å; K76-K79 WeakPolarHBondContact O-CA 3.45Å; K76-K79 WeakPolarHBondContact O-CB 3.42Å; K76-K79 PolarHBondContact O-N 2.87Å; W77-K79 PolarHBondContact O-N 3.48Å; W77-K79 VanDerWaalsContact O-N 3.15Å
80	Q	60.8	Low	71	Confident	155 Å²	155	109.5 Å²	109.5	72%	0.724	50%	0.504	S	S	*	.	H	α-helix	trans	-94.8	-23.6	175	-76.4	-179.3	-60.5	0	0	113.5	K76 W77	K76-Q80 PolarHBondContact O-N 3.47Å; W77-Q80 PolarHBondContact O-N 3.29Å; W77-Q80 VanDerWaalsContact O-N 3.13Å
81	K	55.7	Low	70.7	Confident	68 Å²	68	114.2 Å²	114.2	30%	0.296	52%	0.518	S	S	.	.			trans	-115.4	47.3	179.6	-69.5	-176.7	140.6	-134.3	0	115.6	W77 E83 T84 L85 E88	W77-K81 HydrophobicContact CE3-CD 3.95Å; W77-K81 HydrophobicContact CZ3-CD 4.2Å; W77-K81 PolarHBondContact O-N 3.18Å; K81-E83 PolarHBondContact O-N 3.41Å; K81-T84 HydrophobicContact CB-CG2 4.39Å; K81-T84 HydrophobicContact CD-CG2 4.39Å; K81-T84 WeakPolarHBondContact CD-OG1 3.28Å; K81-T84 WeakPolarHBondContact CE-OG1 3.46Å; K81-T84 HydrophobicContact CG-CG2 4.06Å; K81-T84 PolarHBondContact NZ-OG1 2.89Å; K81-L85 VanDerWaalsContact O-CB 3.31Å; K81-L85 WeakPolarHBondContact O-CB 3.5Å; K81-L85 WeakPolarHBondContact O-CD1 3.13Å; K81-L85 WeakPolarHBondContact O-CG 3.42Å; K81-L85 PolarHBondContact O-N 3.39Å; K81-E88 IonicContact NZ-OE1 2.67Å; K81-E88 PolarHBondContact NZ-OE1 2.79Å
82	P	59.3	Low	70.3	Confident	76 Å²	76	115.1 Å²	115.1	49%	0.494	53%	0.527	S	S	.	.	H	α-helix	trans	-57.7	-38.5	166.4	-20.5	32.3	0	0	0	112.1	N86	P82-N86 PolarHBondContact O-N 2.83Å; P82-N86 PolarHBondContact O-ND2 3.22Å
83	E	54.6	Low	69.9	Low	164 Å²	164	115.7 Å²	115.7	77%	0.766	53%	0.528	S	S	*	.	H	α-helix	trans	-78	-49.1	-172.4	-163.3	162.5	-154.9	0	0	112.2	K81 L85 N86 L87	K81-E83 PolarHBondContact O-N 3.41Å; E83-L85 VanDerWaalsContact C-N 3.29Å; E83-L85 PolarHBondContact O-N 3.01Å; E83-N86 PolarHBondContact O-N 2.87Å; E83-N86 VanDerWaalsContact O-N 3.1Å; E83-L87 PolarHBondContact O-N 3.4Å; E83-L87 VanDerWaalsContact O-N 3.1Å
84	T	58.3	Low	70.1	Confident	49 Å²	49	114 Å²	114	30%	0.301	52%	0.519	S	S	.	.	H	α-helix	trans	-66.7	-30.3	176.7	96.6	0	0	0	0	112.2	K81 N86 L87 E88	K81-T84 HydrophobicContact CB-CG2 4.39Å; K81-T84 HydrophobicContact CD-CG2 4.39Å; K81-T84 WeakPolarHBondContact CD-OG1 3.28Å; K81-T84 WeakPolarHBondContact CE-OG1 3.46Å; K81-T84 HydrophobicContact CG-CG2 4.06Å; K81-T84 PolarHBondContact NZ-OG1 2.89Å; T84-N86 VanDerWaalsContact C-N 3.31Å; T84-N86 PolarHBondContact O-N 3.48Å; T84-L87 PolarHBondContact O-N 2.96Å; T84-E88 WeakPolarHBondContact CB-OE1 3.48Å; T84-E88 VanDerWaalsContact O-CB 3.24Å; T84-E88 WeakPolarHBondContact O-CB 3.16Å; T84-E88 VanDerWaalsContact O-CD 3.29Å; T84-E88 WeakPolarHBondContact O-CG 3.34Å; T84-E88 PolarHBondContact O-N 3.08Å; T84-E88 PolarHBondContact OG1-OE1 2.78Å
85	L	62.3	Low	70.3	Confident	43 Å²	43	113 Å²	113	23%	0.225	52%	0.517	C	S	.	.	H	α-helix	trans	-67.5	-29.7	173.5	-85.6	167.1	0	0	0	113	K81 E83 K89	K81-L85 VanDerWaalsContact O-CB 3.31Å; K81-L85 WeakPolarHBondContact O-CB 3.5Å; K81-L85 WeakPolarHBondContact O-CD1 3.13Å; K81-L85 WeakPolarHBondContact O-CG 3.42Å; K81-L85 PolarHBondContact O-N 3.39Å; E83-L85 VanDerWaalsContact C-N 3.29Å; E83-L85 PolarHBondContact O-N 3.01Å; L85-K89 VanDerWaalsContact O-CB 3.24Å; L85-K89 WeakPolarHBondContact O-CB 3.34Å; L85-K89 WeakPolarHBondContact O-CG 3.38Å; L85-K89 PolarHBondContact O-N 2.92Å
86	N	67.1	Low	70.2	Confident	95 Å²	95	112.9 Å²	112.9	51%	0.508	52%	0.521	S	S	.	.	H	α-helix	trans	-74	-40.3	172.4	-79.8	-63.9	0	0	0	111.3	P82 E83 T84 K89 R90	P82-N86 PolarHBondContact O-N 2.83Å; P82-N86 PolarHBondContact O-ND2 3.22Å; E83-N86 PolarHBondContact O-N 2.87Å; E83-N86 VanDerWaalsContact O-N 3.1Å; T84-N86 VanDerWaalsContact C-N 3.31Å; T84-N86 PolarHBondContact O-N 3.48Å; N86-K89 PolarHBondContact O-N 3.41Å; N86-R90 VanDerWaalsContact O-CB 3.29Å; N86-R90 WeakPolarHBondContact O-CB 3.48Å; N86-R90 PolarHBondContact O-N 2.85Å
87	L	71.4	Confident	70.4	Confident	120 Å²	120	108.2 Å²	108.2	63%	0.628	50%	0.501	S	S	*	.	H	α-helix	trans	-65.9	-41.5	175	-171.9	142.2	0	0	0	112.4	E83 T84 R90 R91	E83-L87 PolarHBondContact O-N 3.4Å; E83-L87 VanDerWaalsContact O-N 3.1Å; T84-L87 PolarHBondContact O-N 2.96Å; L87-R90 PolarHBondContact O-N 2.89Å; L87-R91 WeakPolarHBondContact O-CB 3.33Å; L87-R91 PolarHBondContact O-N 3.47Å
88	E	75.6	Confident	71.4	Confident	78 Å²	78	106.2 Å²	106.2	36%	0.364	50%	0.5	S	S	.	.	H	α-helix	trans	-63.3	-44.2	173.6	-71.6	158.7	-147.7	0	0	111	K81 T84 R91 L92	K81-E88 IonicContact NZ-OE1 2.67Å; K81-E88 PolarHBondContact NZ-OE1 2.79Å; T84-E88 WeakPolarHBondContact CB-OE1 3.48Å; T84-E88 VanDerWaalsContact O-CB 3.24Å; T84-E88 WeakPolarHBondContact O-CB 3.16Å; T84-E88 VanDerWaalsContact O-CD 3.29Å; T84-E88 WeakPolarHBondContact O-CG 3.34Å; T84-E88 PolarHBondContact O-N 3.08Å; T84-E88 PolarHBondContact OG1-OE1 2.78Å; E88-R91 PolarHBondContact O-N 3.27Å; E88-L92 VanDerWaalsContact O-CG 3.32Å; E88-L92 WeakPolarHBondContact O-CG 3.3Å; E88-L92 PolarHBondContact O-N 3.17Å
89	K	79	Confident	71.6	Confident	141 Å²	141	101.9 Å²	101.9	61%	0.613	49%	0.49	S	S	*	.	H	α-helix	trans	-60.9	-47	172.5	-84	178.2	169.1	-164	0	112.8	L85 N86 R91 L92 S93	L85-K89 VanDerWaalsContact O-CB 3.24Å; L85-K89 WeakPolarHBondContact O-CB 3.34Å; L85-K89 WeakPolarHBondContact O-CG 3.38Å; L85-K89 PolarHBondContact O-N 2.92Å; N86-K89 PolarHBondContact O-N 3.41Å; K89-R91 VanDerWaalsContact C-N 3.34Å; K89-R91 PolarHBondContact O-N 2.87Å; K89-L92 PolarHBondContact O-N 3.15Å; K89-S93 PolarHBondContact O-N 3.37Å
90	R	79.2	Confident	71.9	Confident	101 Å²	101	95.9 Å²	95.9	38%	0.381	47%	0.47	S	S	.	.	H	α-helix	trans	-61.2	-43.4	179.3	-178.2	171	173.2	172.1	-2.3	110.7	N86 L87 L92 S93 I94 L211	N86-R90 VanDerWaalsContact O-CB 3.29Å; N86-R90 WeakPolarHBondContact O-CB 3.48Å; N86-R90 PolarHBondContact O-N 2.85Å; L87-R90 PolarHBondContact O-N 2.89Å; R90-L92 PolarHBondContact O-N 2.93Å; R90-S93 PolarHBondContact O-N 3.17Å; R90-I94 HydrophobicContact CG-CD1 3.9Å; R90-I94 WeakPolarHBondContact O-CB 3.38Å; R90-I94 WeakPolarHBondContact O-CD1 3.42Å; R90-I94 VanDerWaalsContact O-CG1 3.28Å; R90-I94 WeakPolarHBondContact O-CG1 3.49Å; R90-I94 PolarHBondContact O-N 2.72Å; R90-L211 HydrophobicContact CG-CD2 4.48Å
91	R	80.1	Confident	72.5	Confident	174 Å²	174	92.3 Å²	92.3	66%	0.657	46%	0.455	S	S	*	.	H	α-helix	trans	-60.1	-43.2	172.8	-177.6	178.7	177.4	-178.5	-0.2	112.3	L87 E88 K89 M95	L87-R91 WeakPolarHBondContact O-CB 3.33Å; L87-R91 PolarHBondContact O-N 3.47Å; E88-R91 PolarHBondContact O-N 3.27Å; K89-R91 VanDerWaalsContact C-N 3.34Å; K89-R91 PolarHBondContact O-N 2.87Å; R91-M95 VanDerWaalsContact O-CB 3.25Å; R91-M95 WeakPolarHBondContact O-CB 3.48Å; R91-M95 PolarHBondContact O-N 3.14Å
92	L	79.3	Confident	73.2	Confident	111 Å²	111	95.1 Å²	95.1	58%	0.581	47%	0.47	S	S	*	.	H	α-helix	trans	-68.7	-34.8	177.1	-72.9	167.9	0	0	0	112.7	E88 K89 R90 M95 K96	E88-L92 VanDerWaalsContact O-CG 3.32Å; E88-L92 WeakPolarHBondContact O-CG 3.3Å; E88-L92 PolarHBondContact O-N 3.17Å; K89-L92 PolarHBondContact O-N 3.15Å; R90-L92 PolarHBondContact O-N 2.93Å; L92-M95 PolarHBondContact O-N 3.37Å; L92-K96 WeakPolarHBondContact O-CB 3.35Å; L92-K96 PolarHBondContact O-N 3.46Å
93	S	77.6	Confident	74	Confident	59 Å²	59	99.9 Å²	99.9	41%	0.413	48%	0.479	S	S	.	.	H	α-helix	trans	-67	-49	175.8	-157.3	0	0	0	0	111.2	K89 R90 M95 K96 E97	K89-S93 PolarHBondContact O-N 3.37Å; R90-S93 PolarHBondContact O-N 3.17Å; S93-M95 VanDerWaalsContact C-N 3.3Å; S93-M95 PolarHBondContact O-N 2.82Å; S93-K96 PolarHBondContact O-N 3.23Å; S93-K96 VanDerWaalsContact O-N 3.13Å; S93-E97 WeakPolarHBondContact O-CB 3.38Å; S93-E97 PolarHBondContact O-N 2.96Å
94	I	82.5	Confident	75.1	Confident	61 Å²	61	96.8 Å²	96.8	31%	0.313	47%	0.465	S	S	.	.	H	α-helix	trans	-59.6	-41.4	174.9	-68.3	164.9	0	0	0	110.8	R90 E97 I98 F207	R90-I94 HydrophobicContact CG-CD1 3.9Å; R90-I94 WeakPolarHBondContact O-CB 3.38Å; R90-I94 WeakPolarHBondContact O-CD1 3.42Å; R90-I94 VanDerWaalsContact O-CG1 3.28Å; R90-I94 WeakPolarHBondContact O-CG1 3.49Å; R90-I94 PolarHBondContact O-N 2.72Å; I94-E97 PolarHBondContact O-N 3.27Å; I94-I98 HydrophobicContact CG2-CD1 3.62Å; I94-I98 HydrophobicContact CG2-CG1 4.32Å; I94-I98 WeakPolarHBondContact O-CB 3.33Å; I94-I98 VanDerWaalsContact O-CG1 3.29Å; I94-I98 WeakPolarHBondContact O-CG1 3.3Å; I94-I98 PolarHBondContact O-N 3.08Å; I94-F207 HydrophobicContact CG1-CE1 4.26Å; I94-F207 HydrophobicContact CG1-CZ 4.13Å
95	M	80.6	Confident	76.2	Confident	89 Å²	89	100.4 Å²	100.4	44%	0.438	48%	0.48	S	S	.	.	H	α-helix	trans	-63.7	-40	175.6	-176.8	178.5	-70.9	0	0	112.2	R91 L92 S93 L99	R91-M95 VanDerWaalsContact O-CB 3.25Å; R91-M95 WeakPolarHBondContact O-CB 3.48Å; R91-M95 PolarHBondContact O-N 3.14Å; L92-M95 PolarHBondContact O-N 3.37Å; S93-M95 VanDerWaalsContact C-N 3.3Å; S93-M95 PolarHBondContact O-N 2.82Å; M95-L99 HydrophobicContact CG-CD1 4.02Å; M95-L99 WeakPolarHBondContact O-CB 3.28Å; M95-L99 WeakPolarHBondContact O-CD1 3.13Å; M95-L99 VanDerWaalsContact O-CG 3.22Å; M95-L99 WeakPolarHBondContact O-CG 3.29Å; M95-L99 PolarHBondContact O-N 3.37Å
96	K	78.1	Confident	77	Confident	153 Å²	153	103.7 Å²	103.7	67%	0.665	49%	0.494	S	S	*	.	H	α-helix	trans	-65.7	-42.4	175.4	-172.9	-177.8	177	-172.8	0	111.7	L92 S93 S100	L92-K96 WeakPolarHBondContact O-CB 3.35Å; L92-K96 PolarHBondContact O-N 3.46Å; S93-K96 PolarHBondContact O-N 3.23Å; S93-K96 VanDerWaalsContact O-N 3.13Å; K96-S100 WeakPolarHBondContact O-CB 3.4Å; K96-S100 PolarHBondContact O-N 3.19Å; K96-S100 PolarHBondContact O-OG 3.32Å
97	E	77.8	Confident	77.9	Confident	45 Å²	45	102.5 Å²	102.5	21%	0.21	49%	0.487	C	S	.	.	H	α-helix	trans	-61.8	-56.8	177.9	-169.6	170.3	-155.1	0	0	111.1	S93 I94 L99 S100 D101 F207	S93-E97 WeakPolarHBondContact O-CB 3.38Å; S93-E97 PolarHBondContact O-N 2.96Å; I94-E97 PolarHBondContact O-N 3.27Å; E97-L99 VanDerWaalsContact C-N 3.31Å; E97-L99 PolarHBondContact O-N 3.45Å; E97-S100 WeakPolarHBondContact O-CA 3.48Å; E97-S100 WeakPolarHBondContact O-CB 3.49Å; E97-S100 PolarHBondContact O-N 3.46Å; E97-D101 PolarHBondContact O-N 2.9Å; E97-F207 WeakPolarHBondContact OE2-CD1 3.48Å; E97-F207 VanDerWaalsContact OE2-CE1 3.3Å; E97-F207 WeakPolarHBondContact OE2-CE1 3.49Å
98	I	81.1	Confident	78.6	Confident	103 Å²	103	101.3 Å²	101.3	53%	0.528	49%	0.485	S	S	.	.	H	α-helix	trans	-55.2	-43.4	178.7	-68.3	169.3	0	0	0	112.1	I94 Q102	I94-I98 HydrophobicContact CG2-CD1 3.62Å; I94-I98 HydrophobicContact CG2-CG1 4.32Å; I94-I98 WeakPolarHBondContact O-CB 3.33Å; I94-I98 VanDerWaalsContact O-CG1 3.29Å; I94-I98 WeakPolarHBondContact O-CG1 3.3Å; I94-I98 PolarHBondContact O-N 3.08Å; I98-Q102 WeakPolarHBondContact O-CB 3.22Å; I98-Q102 PolarHBondContact O-N 3.4Å
99	L	75.2	Confident	79.1	Confident	81 Å²	81	101.6 Å²	101.6	42%	0.424	49%	0.488	S	S	.	.	H	α-helix	trans	-68.2	-37.9	176.9	-68.9	170.8	0	0	0	111.9	M95 E97 Q102 Y103	M95-L99 HydrophobicContact CG-CD1 4.02Å; M95-L99 WeakPolarHBondContact O-CB 3.28Å; M95-L99 WeakPolarHBondContact O-CD1 3.13Å; M95-L99 VanDerWaalsContact O-CG 3.22Å; M95-L99 WeakPolarHBondContact O-CG 3.29Å; M95-L99 PolarHBondContact O-N 3.37Å; E97-L99 VanDerWaalsContact C-N 3.31Å; E97-L99 PolarHBondContact O-N 3.45Å; L99-Q102 PolarHBondContact O-N 3.08Å; L99-Y103 WeakPolarHBondContact O-CD2 3.49Å; L99-Y103 PolarHBondContact O-N 3.24Å
100	S	74.1	Confident	79.5	Confident	48 Å²	48	101.2 Å²	101.2	34%	0.336	49%	0.489	S	S	.	.	H	α-helix	trans	-66.2	-37.6	176.8	-55.9	0	0	0	0	112.1	K96 E97 Y103 Q104	K96-S100 WeakPolarHBondContact O-CB 3.4Å; K96-S100 PolarHBondContact O-N 3.19Å; K96-S100 PolarHBondContact O-OG 3.32Å; E97-S100 WeakPolarHBondContact O-CA 3.48Å; E97-S100 WeakPolarHBondContact O-CB 3.49Å; E97-S100 PolarHBondContact O-N 3.46Å; S100-Y103 PolarHBondContact O-N 2.81Å; S100-Q104 WeakPolarHBondContact O-CG 3.22Å; S100-Q104 PolarHBondContact O-N 3.02Å; S100-Q104 PolarHBondContact O-NE2 3.23Å; S100-Q104 VanDerWaalsContact O-NE2 3.07Å
101	D	73.2	Confident	79.9	Confident	79 Å²	79	101.8 Å²	101.8	42%	0.422	49%	0.494	S	S	.	.	H	α-helix	trans	-69.2	-37.8	175.6	-68.5	-11.5	0	0	0	111.3	E97 Q104 M105	E97-D101 PolarHBondContact O-N 2.9Å; D101-Q104 PolarHBondContact O-N 2.87Å; D101-Q104 PolarHBondContact OD1-NE2 2.88Å; D101-M105 WeakPolarHBondContact O-CB 3.34Å; D101-M105 PolarHBondContact O-N 2.67Å
102	Q	71.4	Confident	80.3	Confident	127 Å²	127	96.2 Å²	96.2	59%	0.593	48%	0.482	S	S	*	.	H	α-helix	trans	-63.3	-40.7	174	-172.1	176.1	-1.1	0	0	112	I98 L99 Q106	I98-Q102 WeakPolarHBondContact O-CB 3.22Å; I98-Q102 PolarHBondContact O-N 3.4Å; L99-Q102 PolarHBondContact O-N 3.08Å; Q102-Q106 WeakPolarHBondContact O-CB 3.37Å; Q102-Q106 PolarHBondContact O-N 3.47Å
103	Y	76.2	Confident	80.7	Confident	177 Å²	177	96.3 Å²	96.3	69%	0.694	48%	0.483	S	S	*	.	H	α-helix	trans	-67.7	-41.2	173.8	-77.9	-65.2	0	0	0	112.7	L99 S100 M105 Q106 D107	L99-Y103 WeakPolarHBondContact O-CD2 3.49Å; L99-Y103 PolarHBondContact O-N 3.24Å; S100-Y103 PolarHBondContact O-N 2.81Å; Y103-M105 PolarHBondContact O-N 3.44Å; Y103-Q106 PolarHBondContact O-N 2.93Å; Y103-D107 PolarHBondContact O-N 2.91Å
104	Q	77.8	Confident	81.2	Confident	99 Å²	99	100 Å²	100	46%	0.463	49%	0.493	S	S	.	.	H	α-helix	trans	-61.8	-42.2	174.2	-77.2	167.7	81	0	0	112	S100 D101 Q106 D107 V108	S100-Q104 WeakPolarHBondContact O-CG 3.22Å; S100-Q104 PolarHBondContact O-N 3.02Å; S100-Q104 PolarHBondContact O-NE2 3.23Å; S100-Q104 VanDerWaalsContact O-NE2 3.07Å; D101-Q104 PolarHBondContact O-N 2.87Å; D101-Q104 PolarHBondContact OD1-NE2 2.88Å; Q104-Q106 VanDerWaalsContact C-N 3.33Å; Q104-Q106 PolarHBondContact O-N 2.97Å; Q104-D107 PolarHBondContact O-N 2.84Å; Q104-V108 WeakPolarHBondContact O-CG2 3.45Å; Q104-V108 PolarHBondContact O-N 2.91Å
105	M	80.7	Confident	81.1	Confident	125 Å²	125	102.8 Å²	102.8	62%	0.616	51%	0.508	S	S	*	.	H	α-helix	trans	-63	-40	175.7	-170.8	-174.3	-57.6	0	0	111.6	D101 Y103 V108 L109	D101-M105 WeakPolarHBondContact O-CB 3.34Å; D101-M105 PolarHBondContact O-N 2.67Å; Y103-M105 PolarHBondContact O-N 3.44Å; M105-V108 PolarHBondContact O-N 3.45Å; M105-L109 HydrophobicContact CG-CD1 4.22Å; M105-L109 WeakPolarHBondContact O-CB 3.21Å; M105-L109 VanDerWaalsContact O-CG 3.28Å; M105-L109 WeakPolarHBondContact O-CG 3.34Å; M105-L109 PolarHBondContact O-N 3.11Å
106	Q	79.2	Confident	80.9	Confident	112 Å²	112	102.7 Å²	102.7	52%	0.523	51%	0.509	S	S	.	.	H	α-helix	trans	-66.1	-40.9	178.1	-172.3	58.5	60.4	0	0	112.3	Q102 Y103 Q104 L109 E110	Q102-Q106 WeakPolarHBondContact O-CB 3.37Å; Q102-Q106 PolarHBondContact O-N 3.47Å; Y103-Q106 PolarHBondContact O-N 2.93Å; Q104-Q106 VanDerWaalsContact C-N 3.33Å; Q104-Q106 PolarHBondContact O-N 2.97Å; Q106-L109 PolarHBondContact O-N 2.87Å; Q106-E110 WeakPolarHBondContact O-CB 3.4Å; Q106-E110 PolarHBondContact O-N 2.93Å
107	D	85.6	Confident	81	Confident	69 Å²	69	97.9 Å²	97.9	37%	0.369	50%	0.498	S	S	.	.	H	α-helix	trans	-63.8	-41.8	173.8	168.9	71	0	0	0	112.3	Y103 Q104 E110 K111	Y103-D107 PolarHBondContact O-N 2.91Å; Q104-D107 PolarHBondContact O-N 2.84Å; D107-E110 PolarHBondContact O-N 3.02Å; D107-K111 WeakPolarHBondContact O-CB 3.22Å; D107-K111 VanDerWaalsContact O-CG 3.31Å; D107-K111 WeakPolarHBondContact O-CG 3.45Å; D107-K111 PolarHBondContact O-N 2.89Å; D107-K111 WeakPolarHBondContact OD1-CE 3.45Å; D107-K111 IonicContact OD1-NZ 2.64Å; D107-K111 PolarHBondContact OD1-NZ 2.79Å; D107-K111 IonicContact OD2-NZ 3.6Å; D107-K111 PolarHBondContact OD2-NZ 3.08Å
108	V	86.6	Confident	80.9	Confident	96 Å²	96	98 Å²	98	58%	0.582	51%	0.506	S	S	*	.	H	α-helix	trans	-64.7	-38.5	174.2	169.8	0	0	0	0	111.8	Q104 M105 S112	Q104-V108 WeakPolarHBondContact O-CG2 3.45Å; Q104-V108 PolarHBondContact O-N 2.91Å; M105-V108 PolarHBondContact O-N 3.45Å; V108-S112 WeakPolarHBondContact O-CB 3.39Å; V108-S112 PolarHBondContact O-N 3.19Å
109	L	86.9	Confident	80.3	Confident	83 Å²	83	94.8 Å²	94.8	44%	0.435	50%	0.495	S	S	.	.	H	α-helix	trans	-67.8	-43.5	174.8	-73.7	169	0	0	0	111.8	M105 Q106 K111 S112 D113	M105-L109 HydrophobicContact CG-CD1 4.22Å; M105-L109 WeakPolarHBondContact O-CB 3.21Å; M105-L109 VanDerWaalsContact O-CG 3.28Å; M105-L109 WeakPolarHBondContact O-CG 3.34Å; M105-L109 PolarHBondContact O-N 3.11Å; Q106-L109 PolarHBondContact O-N 2.87Å; L109-K111 PolarHBondContact O-N 3.32Å; L109-S112 CarbonylContact O-C 3.49Å; L109-S112 WeakPolarHBondContact O-CB 3.3Å; L109-S112 PolarHBondContact O-N 3.5Å; L109-S112 VanDerWaalsContact O-N 3.15Å; L109-D113 PolarHBondContact O-N 3.32Å
110	E	87.1	Confident	79.7	Confident	133 Å²	133	97.5 Å²	97.5	62%	0.621	50%	0.503	S	S	*	.	H	α-helix	trans	-62.9	-41.9	176.7	-174.6	170	172.5	0	0	111.7	Q106 D107 D113 H114	Q106-E110 WeakPolarHBondContact O-CB 3.4Å; Q106-E110 PolarHBondContact O-N 2.93Å; D107-E110 PolarHBondContact O-N 3.02Å; E110-D113 PolarHBondContact O-N 2.52Å; E110-H114 VanDerWaalsContact O-CB 3.29Å; E110-H114 WeakPolarHBondContact O-CB 3.12Å; E110-H114 PolarHBondContact O-N 2.69Å
111	K	87.8	Confident	79.1	Confident	114 Å²	114	103 Å²	103	50%	0.496	52%	0.523	S	S	.	.	H	α-helix	trans	-63.8	-38.4	171.8	-74.4	165.1	178.9	161.9	0	112.3	D107 L109 L115	D107-K111 WeakPolarHBondContact O-CB 3.22Å; D107-K111 VanDerWaalsContact O-CG 3.31Å; D107-K111 WeakPolarHBondContact O-CG 3.45Å; D107-K111 PolarHBondContact O-N 2.89Å; D107-K111 WeakPolarHBondContact OD1-CE 3.45Å; D107-K111 IonicContact OD1-NZ 2.64Å; D107-K111 PolarHBondContact OD1-NZ 2.79Å; D107-K111 IonicContact OD2-NZ 3.6Å; D107-K111 PolarHBondContact OD2-NZ 3.08Å; L109-K111 PolarHBondContact O-N 3.32Å; K111-L115 WeakPolarHBondContact O-CB 3.41Å; K111-L115 VanDerWaalsContact O-CG 3.23Å; K111-L115 WeakPolarHBondContact O-CG 3.38Å; K111-L115 PolarHBondContact O-N 3.43Å
112	S	88.1	Confident	78.6	Confident	57 Å²	57	106 Å²	106	40%	0.399	54%	0.539	S	S	.	.	H	α-helix	trans	-64.8	-47.2	174.3	-177.7	0	0	0	0	111.7	V108 L109 H114 L115 I116	V108-S112 WeakPolarHBondContact O-CB 3.39Å; V108-S112 PolarHBondContact O-N 3.19Å; L109-S112 CarbonylContact O-C 3.49Å; L109-S112 WeakPolarHBondContact O-CB 3.3Å; L109-S112 PolarHBondContact O-N 3.5Å; L109-S112 VanDerWaalsContact O-N 3.15Å; S112-H114 PolarHBondContact O-N 3.1Å; S112-L115 PolarHBondContact O-N 3.09Å; S112-I116 WeakPolarHBondContact O-CB 3.38Å; S112-I116 VanDerWaalsContact O-CG1 3.26Å; S112-I116 WeakPolarHBondContact O-CG1 3.45Å; S112-I116 PolarHBondContact O-N 3.05Å
113	D	86.9	Confident	77.8	Confident	112 Å²	112	107.1 Å²	107.1	60%	0.599	54%	0.542	S	S	*	.	H	α-helix	trans	-65.9	-37.6	178.6	-80.2	-21	0	0	0	111.8	L109 E110 I116 A117	L109-D113 PolarHBondContact O-N 3.32Å; E110-D113 PolarHBondContact O-N 2.52Å; D113-I116 PolarHBondContact O-N 2.74Å; D113-A117 WeakPolarHBondContact O-CB 3.26Å; D113-A117 PolarHBondContact O-N 2.69Å
114	H	87.4	Confident	76.4	Confident	137 Å²	137	103.8 Å²	103.8	63%	0.634	54%	0.542	S	S	*	.	H	α-helix	trans	-63.4	-44.6	172.6	-171.7	86	0	0	0	112.1	E110 S112 A117 A118	E110-H114 VanDerWaalsContact O-CB 3.29Å; E110-H114 WeakPolarHBondContact O-CB 3.12Å; E110-H114 PolarHBondContact O-N 2.69Å; S112-H114 PolarHBondContact O-N 3.1Å; H114-A117 PolarHBondContact O-N 3.11Å; H114-A118 WeakPolarHBondContact O-CB 3.39Å; H114-A118 PolarHBondContact O-N 3.08Å
115	L	82.1	Confident	75.4	Confident	120 Å²	120	107.4 Å²	107.4	63%	0.628	56%	0.558	S	S	*	*	H	α-helix	trans	-64.9	-37.5	174.7	-74.9	168.3	0	0	0	112.2	K111 S112 A119	K111-L115 WeakPolarHBondContact O-CB 3.41Å; K111-L115 VanDerWaalsContact O-CG 3.23Å; K111-L115 WeakPolarHBondContact O-CG 3.38Å; K111-L115 PolarHBondContact O-N 3.43Å; S112-L115 PolarHBondContact O-N 3.09Å; L115-A119 WeakPolarHBondContact O-CB 3.48Å; L115-A119 PolarHBondContact O-N 3.49Å
116	I	76.1	Confident	73.9	Confident	87 Å²	87	113 Å²	113	45%	0.446	57%	0.573	S	S	.	*	H	α-helix	trans	-70.2	-34.4	175.5	-71.5	-69.3	0	0	0	111.6	S112 D113 K120	S112-I116 WeakPolarHBondContact O-CB 3.38Å; S112-I116 VanDerWaalsContact O-CG1 3.26Å; S112-I116 WeakPolarHBondContact O-CG1 3.45Å; S112-I116 PolarHBondContact O-N 3.05Å; D113-I116 PolarHBondContact O-N 2.74Å; I116-K120 VanDerWaalsContact O-CG 3.32Å; I116-K120 WeakPolarHBondContact O-CG 3.33Å; I116-K120 PolarHBondContact O-N 3.45Å
117	A	79.9	Confident	72.4	Confident	52 Å²	52	119 Å²	119	43%	0.43	59%	0.591	S	S	.	*	H	α-helix	trans	-66.8	-49.7	171.9	0	0	0	0	0	111.4	D113 H114 A119 K120 E121	D113-A117 WeakPolarHBondContact O-CB 3.26Å; D113-A117 PolarHBondContact O-N 2.69Å; H114-A117 PolarHBondContact O-N 3.11Å; A117-A119 VanDerWaalsContact C-N 3.29Å; A117-A119 PolarHBondContact O-N 3.41Å; A117-K120 WeakPolarHBondContact O-CB 3.39Å; A117-K120 PolarHBondContact O-N 2.96Å; A117-K120 VanDerWaalsContact O-N 3.11Å; A117-E121 PolarHBondContact O-N 3.27Å
118	A	75.2	Confident	70.4	Confident	47 Å²	47	121.8 Å²	121.8	39%	0.388	61%	0.61	S	S	.	*	H	α-helix	trans	-60.6	-37.6	175.5	0	0	0	0	0	112.4	H114 E121 L122	H114-A118 WeakPolarHBondContact O-CB 3.39Å; H114-A118 PolarHBondContact O-N 3.08Å; A118-E121 PolarHBondContact O-N 2.87Å; A118-L122 PolarHBondContact O-N 2.83Å
119	A	68.5	Low	68	Low	35 Å²	35	120.4 Å²	120.4	29%	0.289	62%	0.616	S	S	.	*	H	α-helix	trans	-67.5	-34.2	174.6	0	0	0	0	0	112.9	L115 A117 E121 L122 F123	L115-A119 WeakPolarHBondContact O-CB 3.48Å; L115-A119 PolarHBondContact O-N 3.49Å; A117-A119 VanDerWaalsContact C-N 3.29Å; A117-A119 PolarHBondContact O-N 3.41Å; A119-E121 VanDerWaalsContact C-N 3.34Å; A119-E121 PolarHBondContact O-N 3.49Å; A119-L122 PolarHBondContact O-N 3.42Å; A119-F123 WeakPolarHBondContact O-CD2 3.5Å
120	K	63.4	Low	65.7	Low	138 Å²	138	125.2 Å²	125.2	60%	0.6	63%	0.634	S	S	*	*	H	α-helix	trans	-63.2	-38	175.3	-81.3	170.1	178.5	174.3	0	112.4	I116 A117 L122 F123	I116-K120 VanDerWaalsContact O-CG 3.32Å; I116-K120 WeakPolarHBondContact O-CG 3.33Å; I116-K120 PolarHBondContact O-N 3.45Å; A117-K120 WeakPolarHBondContact O-CB 3.39Å; A117-K120 PolarHBondContact O-N 2.96Å; A117-K120 VanDerWaalsContact O-N 3.11Å; K120-L122 VanDerWaalsContact C-N 3.25Å; K120-L122 PolarHBondContact O-N 2.86Å; K120-F123 PolarHBondContact O-N 3.35Å
121	E	61.5	Low	63.5	Low	163 Å²	163	124.8 Å²	124.8	76%	0.762	64%	0.642	S	S	*	*	H	α-helix	trans	-67.5	-24.2	175	-65.8	-57.2	132.6	0	0	113	A117 A118 A119	A117-E121 PolarHBondContact O-N 3.27Å; A118-E121 PolarHBondContact O-N 2.87Å; A119-E121 VanDerWaalsContact C-N 3.34Å; A119-E121 PolarHBondContact O-N 3.49Å
122	L	62.4	Low	61	Low	143 Å²	143	126.7 Å²	126.7	75%	0.749	66%	0.658	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.2	-11.3	178.4	-71.5	168.8	0	0	0	114.2	A118 A119 K120	A118-L122 PolarHBondContact O-N 2.83Å; A119-L122 PolarHBondContact O-N 3.42Å; K120-L122 VanDerWaalsContact C-N 3.25Å; K120-L122 PolarHBondContact O-N 2.86Å
123	F	53.6	Low	59	Low	151 Å²	151	131.9 Å²	131.9	66%	0.662	68%	0.679	S	S	*	*	S	Bend	trans	-100.1	112.3	175.4	-67.6	-67.9	0	0	0	111.3	A119 K120 H125	A119-F123 WeakPolarHBondContact O-CD2 3.5Å; K120-F123 PolarHBondContact O-N 3.35Å; F123-H125 PolarHBondContact O-N 3.1Å; F123-H125 VanDerWaalsContact O-N 3.17Å
124	P	47.8	Very low	56.8	Low	107 Å²	107	132.8 Å²	132.8	70%	0.695	69%	0.689	S	S	*	*			trans	-62.1	124.1	176.2	25.7	-33.4	0	0	0	109.4	R126	P124-R126 PolarHBondContact O-N 3.31Å
125	H	57.6	Low	55.1	Low	174 Å²	174	132.4 Å²	132.4	81%	0.806	70%	0.696	S	S	*	*			trans	-54.6	97.9	-172	-83.6	50.4	0	0	0	111.9	F123 R127	F123-H125 PolarHBondContact O-N 3.1Å; F123-H125 VanDerWaalsContact O-N 3.17Å; H125-R127 PolarHBondContact O-N 2.96Å
126	R	48.6	Very low	53	Low	242 Å²	242	130.7 Å²	130.7	91%	0.913	70%	0.7	S	S	*	*			trans	-74	103	179.6	-75.2	-165.2	176.3	-154.6	1.1	109.8	P124	P124-R126 PolarHBondContact O-N 3.31Å
127	R	46.4	Very low	51.3	Low	239 Å²	239	132.7 Å²	132.7	90%	0.902	72%	0.718	S	S	*	*			trans	-15.3	126.9	168.4	-60.1	177.8	-179.5	-178.6	-1.1	114.6	H125 G129	H125-R127 PolarHBondContact O-N 2.96Å; R127-G129 PolarHBondContact O-N 3.37Å
128	T	44.3	Very low	48.9	Very low	127 Å²	127	138.4 Å²	138.4	78%	0.779	74%	0.741	S	S	*	*			trans	-45.1	111.3	167.6	-52.7	0	0	0	0	111.6
129	G	35.8	Very low	47	Very low	68 Å²	68	141.3 Å²	141.3	70%	0.701	76%	0.759	S	S	*	*			trans	-89.9	114.3	174	0	0	0	0	0	110.7	R127	R127-G129 PolarHBondContact O-N 3.37Å
130	F	38.3	Very low	45.5	Very low	184 Å²	184	144.2 Å²	144.2	81%	0.807	78%	0.777	S	S	*	*			trans	-69	133.1	169.5	-65.8	-89.7	0	0	0	109.9	N132	F130-N132 PolarHBondContact O-N 3.5Å
131	P	41	Very low	44.1	Very low	124 Å²	124	146.3 Å²	146.3	81%	0.805	79%	0.789	S	S	*	*			trans	-76.2	95.6	177.7	30.6	-33.5	0	0	0	110.2
132	N	35.7	Very low	42.7	Very low	154 Å²	154	141.6 Å²	141.6	82%	0.824	79%	0.785	S	S	*	*			trans	-72.7	137.5	168.4	-118.5	-3.6	0	0	0	109.8	F130 T134	F130-N132 PolarHBondContact O-N 3.5Å; N132-T134 PolarHBondContact O-N 2.82Å
133	I	47.4	Very low	41.9	Very low	165 Å²	165	140.2 Å²	140.2	85%	0.846	78%	0.784	S	S	*	*			trans	-75.6	111	-178	-60.8	168.5	0	0	0	109.1
134	T	40.8	Very low	40.9	Very low	131 Å²	131	140.3 Å²	140.3	80%	0.804	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-103.6	119.7	173.1	-53.2	0	0	0	0	109.9	N132	N132-T134 PolarHBondContact O-N 2.82Å
135	V	50.5	Low	40.1	Very low	129 Å²	129	141 Å²	141	78%	0.782	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-68.7	149.5	176.7	-133.6	0	0	0	0	110.8
136	A	38.9	Very low	38.9	Very low	85 Å²	85	138.2 Å²	138.2	70%	0.702	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-70.7	141.7	172.8	0	0	0	0	0	111
137	P	39.6	Very low	38.1	Very low	129 Å²	129	133.9 Å²	133.9	84%	0.838	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-82.7	141	-178.7	32.4	-34.6	0	0	0	112.9
138	D	30.3	Very low	37.5	Very low	171 Å²	171	131.1 Å²	131.1	91%	0.914	78%	0.779	S	S	*	*			trans	-82.3	176.3	176.5	-84.1	-54.2	0	0	0	114
139	S	34	Very low	37	Very low	108 Å²	108	132.3 Å²	132.3	76%	0.755	78%	0.781	S	S	*	*			trans	-84.6	158.3	-164.6	-173	0	0	0	0	116.5
140	S	36.8	Very low	37.5	Very low	97 Å²	97	134.5 Å²	134.5	68%	0.678	78%	0.783	S	S	*	*			trans	103.8	146.5	146.5	79.5	0	0	0	0	120.8
141	Q	34.4	Very low	37.1	Very low	181 Å²	181	131.9 Å²	131.9	85%	0.846	78%	0.782	S	S	*	*			trans	62.1	130.9	165.7	-103.2	62.8	-17.1	0	0	121.4
142	G	32.8	Very low	36.8	Very low	65 Å²	65	131.6 Å²	131.6	67%	0.67	78%	0.777	S	S	*	*			trans	-102.4	-148.4	157.6	0	0	0	0	0	111.1
143	P	44.7	Very low	36.7	Very low	114 Å²	114	133.1 Å²	133.1	74%	0.74	78%	0.78	S	S	*	*			cis	-145.6	-175.8	3.5	46	-28.1	0	0	0	116.9
144	I	33.3	Very low	36	Very low	152 Å²	152	130.8 Å²	130.8	78%	0.779	78%	0.778	S	S	*	*			trans	76.2	158.8	154.4	-70.8	162.2	0	0	0	119
145	V	31.4	Very low	35.7	Very low	123 Å²	123	129 Å²	129	75%	0.745	77%	0.766	S	S	*	*			trans	77.9	100.6	-175.5	-166.6	0	0	0	0	113.6
146	V	32.5	Very low	34.7	Very low	115 Å²	115	132.2 Å²	132.2	70%	0.697	77%	0.771	S	S	*	*			cis	74.6	102.5	48.5	-175	0	0	0	0	114.2
147	N	31.9	Very low	34.2	Very low	151 Å²	151	133.7 Å²	133.7	81%	0.807	77%	0.767	S	S	*	*				-166.4	153.8	125.8	-98.9	-44.1	0	0	0	112.9
148	Q	32.7	Very low	34	Very low	181 Å²	181	135.8 Å²	135.8	85%	0.846	77%	0.765	S	S	*	*			trans	-70.7	153	-155.5	-55.4	170.3	7.9	0	0	117.2
149	D	35.2	Very low	34	Very low	152 Å²	152	132.7 Å²	132.7	81%	0.813	76%	0.757	S	S	*	*			trans	-69.4	175.5	157.2	-53.9	-67.1	0	0	0	111.7
150	P	46.1	Very low	34	Very low	113 Å²	113	133.4 Å²	133.4	73%	0.734	76%	0.756	S	S	*	*				-147.5	169.5	97.8	41	-26.9	0	0	0	115.8
151	V	29.3	Very low	33.7	Very low	130 Å²	130	135.9 Å²	135.9	79%	0.788	76%	0.761	S	S	*	*			trans	73.4	113.7	167.5	-173.6	0	0	0	0	114
152	T	35.1	Very low	33.9	Very low	117 Å²	117	136 Å²	136	72%	0.718	76%	0.761	S	S	*	*			cis	-156.7	163.3	12.7	-5.4	0	0	0	0	113.4
153	Q	34.1	Very low	34.4	Very low	187 Å²	187	137 Å²	137	87%	0.874	76%	0.755	S	S	*	*			trans	69.7	73.7	155	-67.1	178.3	24.9	0	0	119.5
154	S	31.4	Very low	33.7	Very low	116 Å²	116	140.1 Å²	140.1	81%	0.811	76%	0.76	S	S	*	*				-120.3	160.9	127	63	0	0	0	0	106.6
155	V	35.4	Very low	33.6	Very low	92 Å²	92	136.8 Å²	136.8	56%	0.558	76%	0.756	S	S	*	*			cis	-149.9	153.6	21.5	167.4	0	0	0	0	108	N157	V155-N157 VanDerWaalsContact CG1-OD1 3.31Å; V155-N157 WeakPolarHBondContact CG1-OD1 3.33Å
156	F	28.9	Very low	33.6	Very low	198 Å²	198	137.3 Å²	137.3	87%	0.868	75%	0.753	S	S	*	*			trans	-177.9	113.2	136.7	-77.4	-49.7	0	0	0	106.9
157	N	29.3	Very low	33.6	Very low	116 Å²	116	139.2 Å²	139.2	62%	0.62	76%	0.759	S	S	*	*				62.3	106.2	72.5	-61.1	10.8	0	0	0	110.5	V155	V155-N157 VanDerWaalsContact CG1-OD1 3.31Å; V155-N157 WeakPolarHBondContact CG1-OD1 3.33Å
158	E	33.5	Very low	33.8	Very low	173 Å²	173	141.6 Å²	141.6	81%	0.808	76%	0.759	S	S	*	*				80	140.4	76.8	-174.9	176.3	-168.9	0	0	112.6
159	S	30.9	Very low	34	Very low	106 Å²	106	140 Å²	140	74%	0.741	76%	0.761	S	S	*	*			trans	74.4	154.1	-179.1	-72.4	0	0	0	0	117.7
160	V	33.7	Very low	33.9	Very low	122 Å²	122	139.9 Å²	139.9	74%	0.739	76%	0.76	S	S	*	*			cis	-171.7	176.8	-34.6	109	0	0	0	0	108.7
161	I	31.6	Very low	33.2	Very low	150 Å²	150	137.8 Å²	137.8	77%	0.769	76%	0.759	S	S	*	*			trans	92.8	121.5	172.4	-62.3	135.7	0	0	0	117.9
162	E	38.6	Very low	33.4	Very low	184 Å²	184	140 Å²	140	86%	0.86	76%	0.761	S	S	*	*			trans	-109.9	135.3	149.4	157.7	-179.2	-149.3	0	0	105.5
163	P	43.4	Very low	33.4	Very low	84 Å²	84	143.8 Å²	143.8	55%	0.545	77%	0.77	S	S	.	*				-158	165	97	42.4	-22.9	0	0	0	118.6
164	Q	30.6	Very low	33.2	Very low	181 Å²	181	143.5 Å²	143.5	85%	0.846	77%	0.769	S	S	*	*			trans	66	165.1	151.5	-71.6	155.7	-14.7	0	0	118.2
165	A	31.2	Very low	33	Very low	82 Å²	82	141.8 Å²	141.8	68%	0.678	77%	0.77	S	S	*	*			cis	-171.2	154	-39.8	0	0	0	0	0	108.1
166	L	31	Very low	32.4	Very low	134 Å²	134	142.6 Å²	142.6	70%	0.702	78%	0.775	S	S	*	*			trans	41.9	115.9	157.4	-99.5	162	0	0	0	118.8	Y168	L166-Y168 HydrophobicContact CD2-CD2 4.26Å; L166-Y168 HydrophobicContact CD2-CE2 4.27Å
167	N	31	Very low	32.3	Very low	154 Å²	154	140.4 Å²	140.4	82%	0.824	77%	0.771	S	S	*	*				-162.6	157	107.2	-105.4	-34.5	0	0	0	114.5
168	Y	35.9	Very low	32.1	Very low	201 Å²	201	141.5 Å²	141.5	79%	0.788	78%	0.777	S	S	*	*			trans	-76.5	148.3	166.5	-70.2	-110.3	0	0	0	109.9	L166	L166-Y168 HydrophobicContact CD2-CD2 4.26Å; L166-Y168 HydrophobicContact CD2-CE2 4.27Å
169	V	37.6	Very low	31.7	Very low	148 Å²	148	137.9 Å²	137.9	90%	0.897	77%	0.77	S	S	*	*			trans	-126.9	114.5	148.5	174.2	0	0	0	0	107.1
170	D	33.3	Very low	31.5	Very low	149 Å²	149	141.7 Å²	141.7	80%	0.797	78%	0.777	S	S	*	*			trans	-79.2	150.5	166.1	-174	16.3	0	0	0	108.9
171	G	31.7	Very low	31.1	Very low	69 Å²	69	141.5 Å²	141.5	71%	0.711	78%	0.781	S	S	*	*			trans	-178.7	64.8	-162.8	0	0	0	0	0	116.1
172	E	32.2	Very low	30.9	Very low	176 Å²	176	138.1 Å²	138.1	82%	0.822	78%	0.782	S	S	*	*			trans	-40.3	134.1	162.1	-57	-85.3	-166.6	0	0	113.9
173	E	35.8	Very low	30.3	Very low	197 Å²	197	138.4 Å²	138.4	92%	0.921	78%	0.784	S	S	*	*			trans	-153.8	145.4	140.2	-155.5	162.3	-151.3	0	0	112
174	E	29.5	Very low	29.6	Very low	182 Å²	182	140.3 Å²	140.3	85%	0.85	80%	0.799	S	S	*	*			trans	-85.7	146.1	-173.6	-60.4	177.7	104.2	0	0	113
175	G	28.3	Very low	29.6	Very low	80 Å²	80	140.5 Å²	140.5	83%	0.825	80%	0.8	S	S	*	*			trans	-137.1	12.5	-171.5	0	0	0	0	0	117.7
176	T	23.3	Very low	29.4	Very low	108 Å²	108	141.7 Å²	141.7	66%	0.663	80%	0.803	S	S	*	*			trans	15	129.7	154.9	-52.1	0	0	0	0	121.1
177	I	26.2	Very low	29.4	Very low	152 Å²	152	143.9 Å²	143.9	78%	0.779	81%	0.81	S	S	*	*			trans	66.7	152.4	166.5	66.1	164	0	0	0	118.3
178	N	24.5	Very low	29.4	Very low	139 Å²	139	144 Å²	144	74%	0.743	81%	0.81	S	S	*	*			cis	-139.5	164.3	14.8	-156.2	13.2	0	0	0	115.4
179	S	26.4	Very low	29.2	Very low	97 Å²	97	143.4 Å²	143.4	68%	0.678	82%	0.815	S	S	*	*			trans	-89.8	-179.4	-172.1	-55.4	0	0	0	0	114.9
180	Q	25.1	Very low	29.3	Very low	187 Å²	187	143.9 Å²	143.9	87%	0.874	81%	0.812	S	S	*	*			trans	94	148	169.9	-57.9	-173	-68.7	0	0	115.5
181	S	25.4	Very low	29.4	Very low	118 Å²	118	144.2 Å²	144.2	83%	0.825	81%	0.814	S	S	*	*			cis	-175.2	133.3	-21.2	176	0	0	0	0	106.9
182	G	27.1	Very low	29.6	Very low	78 Å²	78	149.5 Å²	149.5	80%	0.804	83%	0.825	S	S	*	*			trans	177.4	128.5	177.5	0	0	0	0	0	112.7
183	E	26.1	Very low	29.5	Very low	191 Å²	191	147.4 Å²	147.4	89%	0.893	82%	0.82	S	S	*	*			trans	-102.1	166.3	178.3	-59.4	171.7	128.3	0	0	110.6
184	S	29.5	Very low	29.6	Very low	123 Å²	123	145.3 Å²	145.3	86%	0.86	82%	0.815	S	S	*	*			trans	109.2	159.1	159	-46.8	0	0	0	0	117.1
185	E	29.6	Very low	29.9	Very low	185 Å²	185	141.9 Å²	141.9	86%	0.864	81%	0.811	S	S	*	*			trans	-104.7	-175.6	-164.5	-52.7	176.7	125.2	0	0	112.2
186	S	28.9	Very low	30.4	Very low	107 Å²	107	144.1 Å²	144.1	75%	0.748	80%	0.804	S	S	*	*			trans	85.4	119.2	163.9	70.9	0	0	0	0	119.6
187	E	30.6	Very low	31.2	Very low	181 Å²	181	146.8 Å²	146.8	85%	0.846	81%	0.814	S	S	*	*			trans	67	120.4	137.5	-62.9	177.9	-162.6	0	0	120.9
188	N	30.4	Very low	31.8	Very low	155 Å²	155	144.6 Å²	144.6	83%	0.829	81%	0.812	S	S	*	*			trans	32.2	123.7	155.3	-64.1	1.6	0	0	0	120.3
189	E	31.2	Very low	32.7	Very low	190 Å²	190	143.8 Å²	143.8	89%	0.888	80%	0.804	S	S	*	*				-155.8	176.6	94.8	-114.2	171.2	-164.4	0	0	112.3
190	N	40.4	Very low	33.8	Very low	157 Å²	157	143 Å²	143	84%	0.84	80%	0.798	S	S	*	*			trans	-84.8	113.9	179.8	-59.7	-57.7	0	0	0	109.9
191	D	36.3	Very low	35	Very low	157 Å²	157	139.2 Å²	139.2	84%	0.84	78%	0.784	S	S	*	*			trans	-158.9	98.2	157.4	-99.3	-30.8	0	0	0	110.5
192	L	34.8	Very low	36.3	Very low	179 Å²	179	136.7 Å²	136.7	94%	0.937	76%	0.763	S	S	*	*			trans	-143.4	95.1	163.5	-91.4	-177.5	0	0	0	109.8
193	D	31.1	Very low	37.8	Very low	133 Å²	133	137.2 Å²	137.2	71%	0.711	75%	0.748	S	S	*	*			trans	-64.4	131.6	-179.4	-118.3	-42.5	0	0	0	113	S195	D193-S195 PolarHBondContact O-N 2.73Å; D193-S195 VanDerWaalsContact O-N 3.15Å
194	N	36.3	Very low	39.5	Very low	152 Å²	152	130.3 Å²	130.3	81%	0.813	72%	0.719	S	S	*	*	S	Bend	trans	42.3	55.6	143.1	-76.5	-64.6	0	0	0	119.6
195	S	36.1	Very low	41.1	Very low	111 Å²	111	128.8 Å²	128.8	78%	0.776	70%	0.701	S	S	*	*			trans	-149.6	46.2	163.2	-155.2	0	0	0	0	115.5	D193	D193-S195 PolarHBondContact O-N 2.73Å; D193-S195 VanDerWaalsContact O-N 3.15Å
196	L	38.3	Very low	43.1	Very low	127 Å²	127	126.1 Å²	126.1	67%	0.665	68%	0.683	S	S	*	*			trans	-137.6	58.7	-178.5	-73.1	177.5	0	0	0	114.5	Q199	L196-Q199 HydrophobicContact CD2-CB 4.22Å; L196-Q199 HydrophobicContact CD2-CG 3.76Å
197	N	41.4	Very low	44.9	Very low	163 Å²	163	123.2 Å²	123.2	87%	0.872	66%	0.657	S	S	*	*	S	Bend	trans	-107.6	19.3	171.7	-158.1	19.2	0	0	0	114.6
198	S	38.9	Very low	46.9	Very low	107 Å²	107	119.5 Å²	119.5	75%	0.748	64%	0.642	S	S	*	*	S	Bend	trans	-139.3	1.9	-179.2	-54	0	0	0	0	115.2
199	Q	43.7	Very low	48.9	Very low	122 Å²	122	118.3 Å²	118.3	57%	0.57	63%	0.632	S	S	*	*	S	Bend	trans	-93.2	-23.6	-175	-75.8	-160.4	4.2	0	0	115.4	L196 N201 T202 N203	L196-Q199 HydrophobicContact CD2-CB 4.22Å; L196-Q199 HydrophobicContact CD2-CG 3.76Å; Q199-N201 PolarHBondContact O-N 2.94Å; Q199-T202 WeakPolarHBondContact O-CB 3.49Å; Q199-T202 PolarHBondContact O-N 3.11Å; Q199-T202 PolarHBondContact O-OG1 3.26Å; Q199-N203 PolarHBondContact O-N 2.74Å
200	S	48.7	Very low	51.1	Low	79 Å²	79	114.2 Å²	114.2	55%	0.552	61%	0.613	S	S	*	*	H	α-helix	trans	-53.1	-53.6	-173	50.7	0	0	0	0	112.7	T202 N203 T204	S200-T202 PolarHBondContact O-N 3.03Å; S200-N203 WeakPolarHBondContact O-CB 3.43Å; S200-N203 PolarHBondContact O-N 3.45Å; S200-T204 PolarHBondContact O-N 2.92Å
201	N	50.3	Low	52.5	Low	109 Å²	109	107.7 Å²	107.7	58%	0.583	58%	0.578	S	S	*	*	H	α-helix	trans	-66.3	-20.2	179.7	-158.7	55.9	0	0	0	113.7	Q199 N203 T204 D205	Q199-N201 PolarHBondContact O-N 2.94Å; N201-N203 VanDerWaalsContact C-N 3.27Å; N201-T204 WeakPolarHBondContact CA-OG1 3.27Å; N201-T204 PolarHBondContact O-OG1 3.15Å; N201-T204 VanDerWaalsContact O-OG1 3.04Å; N201-D205 PolarHBondContact O-N 3.4Å
202	T	53.7	Low	54.2	Low	64 Å²	64	104.6 Å²	104.6	39%	0.393	57%	0.565	S	S	.	*	H	α-helix	trans	-76.5	-17.6	173.6	78.8	0	0	0	0	112.6	Q199 S200 R206	Q199-T202 WeakPolarHBondContact O-CB 3.49Å; Q199-T202 PolarHBondContact O-N 3.11Å; Q199-T202 PolarHBondContact O-OG1 3.26Å; S200-T202 PolarHBondContact O-N 3.03Å; T202-R206 VanDerWaalsContact O-CB 3.23Å; T202-R206 WeakPolarHBondContact O-CB 3.31Å; T202-R206 VanDerWaalsContact O-CZ 3.24Å; T202-R206 PolarHBondContact O-N 2.65Å; T202-R206 PolarHBondContact O-NH2 2.83Å; T202-R206 VanDerWaalsContact O-NH2 3.1Å; T202-R206 PolarHBondContact OG1-NH2 2.88Å; T202-R206 VanDerWaalsContact OG1-NH2 3.14Å
203	N	57.4	Low	56.3	Low	90 Å²	90	101.7 Å²	101.7	48%	0.481	55%	0.546	S	S	.	.	H	α-helix	trans	-88.9	-41.9	-178.8	-158.8	37.8	0	0	0	111.3	Q199 S200 N201 R206 F207	Q199-N203 PolarHBondContact O-N 2.74Å; S200-N203 WeakPolarHBondContact O-CB 3.43Å; S200-N203 PolarHBondContact O-N 3.45Å; N201-N203 VanDerWaalsContact C-N 3.27Å; N203-R206 PolarHBondContact O-N 2.98Å; N203-R206 PolarHBondContact OD1-NH1 2.57Å; N203-F207 WeakPolarHBondContact O-CB 3.32Å; N203-F207 PolarHBondContact O-N 3.33Å
204	T	62.6	Low	58.4	Low	45 Å²	45	99 Å²	99	28%	0.276	53%	0.529	S	S	.	.	H	α-helix	trans	-61	-49	173.2	48.7	0	0	0	0	111.6	S200 N201 R206 F207 L208	S200-T204 PolarHBondContact O-N 2.92Å; N201-T204 WeakPolarHBondContact CA-OG1 3.27Å; N201-T204 PolarHBondContact O-OG1 3.15Å; N201-T204 VanDerWaalsContact O-OG1 3.04Å; T204-R206 VanDerWaalsContact C-N 3.33Å; T204-R206 PolarHBondContact O-N 3.23Å; T204-F207 PolarHBondContact O-N 3.34Å; T204-L208 WeakPolarHBondContact O-CB 3.42Å; T204-L208 WeakPolarHBondContact O-CG 3.1Å; T204-L208 PolarHBondContact O-N 3.5Å
205	D	63.5	Low	60.3	Low	92 Å²	92	95 Å²	95	49%	0.492	51%	0.508	S	S	.	.	H	α-helix	trans	-61.6	-39.7	176.9	-82	-19.2	0	0	0	112.1	N201 L208 Q209	N201-D205 PolarHBondContact O-N 3.4Å; D205-L208 PolarHBondContact O-N 2.86Å; D205-Q209 WeakPolarHBondContact O-CB 3.39Å; D205-Q209 PolarHBondContact O-N 3.01Å
206	R	70.9	Confident	62.1	Low	129 Å²	129	92.8 Å²	92.8	49%	0.487	49%	0.493	S	S	.	.	H	α-helix	trans	-66.4	-38.6	176.2	-171.5	-170.1	-52.2	117.1	7.6	112.1	T202 N203 T204 Q209 Q210	T202-R206 VanDerWaalsContact O-CB 3.23Å; T202-R206 WeakPolarHBondContact O-CB 3.31Å; T202-R206 VanDerWaalsContact O-CZ 3.24Å; T202-R206 PolarHBondContact O-N 2.65Å; T202-R206 PolarHBondContact O-NH2 2.83Å; T202-R206 VanDerWaalsContact O-NH2 3.1Å; T202-R206 PolarHBondContact OG1-NH2 2.88Å; T202-R206 VanDerWaalsContact OG1-NH2 3.14Å; N203-R206 PolarHBondContact O-N 2.98Å; N203-R206 PolarHBondContact OD1-NH1 2.57Å; T204-R206 VanDerWaalsContact C-N 3.33Å; T204-R206 PolarHBondContact O-N 3.23Å; R206-Q209 PolarHBondContact O-N 3.42Å; R206-Q210 WeakPolarHBondContact O-CB 3.43Å; R206-Q210 PolarHBondContact O-N 2.97Å
207	F	67.1	Low	64	Low	45 Å²	45	91.4 Å²	91.4	20%	0.197	48%	0.483	C	S	.	.	H	α-helix	trans	-69.4	-42.6	175.5	178.4	-126.3	0	0	0	111.7	I94 E97 N203 T204 Q209 Q210 L211	I94-F207 HydrophobicContact CG1-CE1 4.26Å; I94-F207 HydrophobicContact CG1-CZ 4.13Å; E97-F207 WeakPolarHBondContact OE2-CD1 3.48Å; E97-F207 VanDerWaalsContact OE2-CE1 3.3Å; E97-F207 WeakPolarHBondContact OE2-CE1 3.49Å; N203-F207 WeakPolarHBondContact O-CB 3.32Å; N203-F207 PolarHBondContact O-N 3.33Å; T204-F207 PolarHBondContact O-N 3.34Å; F207-Q209 VanDerWaalsContact C-N 3.33Å; F207-Q209 PolarHBondContact O-N 3.21Å; F207-Q210 PolarHBondContact O-N 3.36Å; F207-L211 HydrophobicContact CD1-CD1 4.24Å; F207-L211 HydrophobicContact CD2-CG 4.23Å; F207-L211 HydrophobicContact CE1-CD1 3.77Å; F207-L211 HydrophobicContact CE1-CG 4.41Å; F207-L211 HydrophobicContact CE2-CD1 4.13Å; F207-L211 HydrophobicContact CE2-CD2 3.98Å; F207-L211 HydrophobicContact CE2-CG 3.9Å; F207-L211 HydrophobicContact CZ-CD1 3.71Å; F207-L211 HydrophobicContact CZ-CD2 4.13Å; F207-L211 HydrophobicContact CZ-CG 4Å; F207-L211 WeakPolarHBondContact O-CB 3.35Å; F207-L211 WeakPolarHBondContact O-CG 3.13Å; F207-L211 PolarHBondContact O-N 2.96Å
208	L	72.3	Confident	65.9	Low	103 Å²	103	88.7 Å²	88.7	54%	0.539	47%	0.468	S	S	.	.	H	α-helix	trans	-59	-44.6	171.6	-73.4	172.1	0	0	0	111.3	T204 D205 L211 T212	T204-L208 WeakPolarHBondContact O-CB 3.42Å; T204-L208 WeakPolarHBondContact O-CG 3.1Å; T204-L208 PolarHBondContact O-N 3.5Å; D205-L208 PolarHBondContact O-N 2.86Å; L208-L211 PolarHBondContact O-N 3.41Å; L208-T212 WeakPolarHBondContact O-CG2 3.24Å; L208-T212 PolarHBondContact O-N 2.92Å; L208-T212 PolarHBondContact O-OG1 3.45Å
209	Q	72.1	Confident	67.9	Low	130 Å²	130	89.4 Å²	89.4	61%	0.607	46%	0.462	S	S	*	.	H	α-helix	trans	-59.5	-49.6	175.4	-172.4	171.7	5.1	0	0	111.1	D205 R206 F207 L211 T212 E213	D205-Q209 WeakPolarHBondContact O-CB 3.39Å; D205-Q209 PolarHBondContact O-N 3.01Å; R206-Q209 PolarHBondContact O-N 3.42Å; F207-Q209 VanDerWaalsContact C-N 3.33Å; F207-Q209 PolarHBondContact O-N 3.21Å; Q209-L211 VanDerWaalsContact C-N 3.34Å; Q209-L211 PolarHBondContact O-N 3.29Å; Q209-T212 PolarHBondContact O-N 2.86Å; Q209-T212 VanDerWaalsContact O-N 3.1Å; Q209-T212 PolarHBondContact O-OG1 2.9Å; Q209-E213 WeakPolarHBondContact O-CB 3.5Å; Q209-E213 PolarHBondContact O-N 2.95Å
210	Q	77.1	Confident	69.7	Low	104 Å²	104	86.4 Å²	86.4	49%	0.486	46%	0.455	S	S	.	.	H	α-helix	trans	-60.6	-40.1	176.3	-177.2	171.7	-20.6	0	0	112.4	R206 F207 T212 E213 E214	R206-Q210 WeakPolarHBondContact O-CB 3.43Å; R206-Q210 PolarHBondContact O-N 2.97Å; F207-Q210 PolarHBondContact O-N 3.36Å; Q210-T212 VanDerWaalsContact C-N 3.34Å; Q210-T212 PolarHBondContact O-N 3.34Å; Q210-E213 PolarHBondContact O-N 2.98Å; Q210-E214 HydrophobicContact CG-CG 4.24Å; Q210-E214 PolarHBondContact NE2-OE1 2.91Å; Q210-E214 WeakPolarHBondContact O-CB 3.45Å; Q210-E214 WeakPolarHBondContact O-CG 3.33Å; Q210-E214 PolarHBondContact O-N 3.37Å
211	L	69.8	Low	71.5	Confident	21 Å²	21	88 Å²	88	11%	0.11	45%	0.451	C	S	.	.	H	α-helix	trans	-63.7	-36.6	174.4	-73	-177.2	0	0	0	112.5	R90 F207 L208 Q209 N215	R90-L211 HydrophobicContact CG-CD2 4.48Å; F207-L211 HydrophobicContact CD1-CD1 4.24Å; F207-L211 HydrophobicContact CD2-CG 4.23Å; F207-L211 HydrophobicContact CE1-CD1 3.77Å; F207-L211 HydrophobicContact CE1-CG 4.41Å; F207-L211 HydrophobicContact CE2-CD1 4.13Å; F207-L211 HydrophobicContact CE2-CD2 3.98Å; F207-L211 HydrophobicContact CE2-CG 3.9Å; F207-L211 HydrophobicContact CZ-CD1 3.71Å; F207-L211 HydrophobicContact CZ-CD2 4.13Å; F207-L211 HydrophobicContact CZ-CG 4Å; F207-L211 WeakPolarHBondContact O-CB 3.35Å; F207-L211 WeakPolarHBondContact O-CG 3.13Å; F207-L211 PolarHBondContact O-N 2.96Å; L208-L211 PolarHBondContact O-N 3.41Å; Q209-L211 VanDerWaalsContact C-N 3.34Å; Q209-L211 PolarHBondContact O-N 3.29Å; L211-N215 VanDerWaalsContact O-CB 3.3Å; L211-N215 WeakPolarHBondContact O-CB 3.38Å; L211-N215 PolarHBondContact O-N 3.48Å; L211-N215 VanDerWaalsContact O-N 3.11Å; L211-N215 PolarHBondContact O-ND2 3.3Å; L211-N215 VanDerWaalsContact O-ND2 3.12Å
212	T	72.1	Confident	73.2	Confident	92 Å²	92	87.9 Å²	87.9	56%	0.564	45%	0.45	S	S	*	.	H	α-helix	trans	-70.5	-37.2	173.6	60	0	0	0	0	112.3	L208 Q209 Q210 S216	L208-T212 WeakPolarHBondContact O-CG2 3.24Å; L208-T212 PolarHBondContact O-N 2.92Å; L208-T212 PolarHBondContact O-OG1 3.45Å; Q209-T212 PolarHBondContact O-N 2.86Å; Q209-T212 VanDerWaalsContact O-N 3.1Å; Q209-T212 PolarHBondContact O-OG1 2.9Å; Q210-T212 VanDerWaalsContact C-N 3.34Å; Q210-T212 PolarHBondContact O-N 3.34Å; T212-S216 WeakPolarHBondContact O-CB 3.35Å; T212-S216 PolarHBondContact O-N 2.67Å
213	E	80.1	Confident	74.2	Confident	118 Å²	118	92.5 Å²	92.5	55%	0.551	46%	0.461	S	S	*	.	H	α-helix	trans	-68.6	-48.4	178.2	-169.9	156.5	-142.4	0	0	111.2	Q209 Q210 N215 S216 E217	Q209-E213 WeakPolarHBondContact O-CB 3.5Å; Q209-E213 PolarHBondContact O-N 2.95Å; Q210-E213 PolarHBondContact O-N 2.98Å; E213-N215 VanDerWaalsContact C-N 3.35Å; E213-N215 PolarHBondContact O-N 3.3Å; E213-S216 CarbonylContact O-C 3.54Å; E213-S216 WeakPolarHBondContact O-CA 3.29Å; E213-S216 WeakPolarHBondContact O-CB 3.4Å; E213-S216 PolarHBondContact O-N 3.12Å; E213-S216 PolarHBondContact O-OG 3.1Å; E213-E217 PolarHBondContact O-N 3.34Å
214	E	74.2	Confident	75.4	Confident	76 Å²	76	91.8 Å²	91.8	36%	0.355	46%	0.459	S	S	.	.	H	α-helix	trans	-58.5	-42.3	173.7	-74.4	-179.8	-169	0	0	112.2	Q210 S216 E217 L218	Q210-E214 HydrophobicContact CG-CG 4.24Å; Q210-E214 PolarHBondContact NE2-OE1 2.91Å; Q210-E214 WeakPolarHBondContact O-CB 3.45Å; Q210-E214 WeakPolarHBondContact O-CG 3.33Å; Q210-E214 PolarHBondContact O-N 3.37Å; E214-S216 VanDerWaalsContact C-N 3.35Å; E214-S216 PolarHBondContact O-N 3.36Å; E214-E217 PolarHBondContact O-N 3.2Å; E214-L218 WeakPolarHBondContact O-CG 3.23Å; E214-L218 PolarHBondContact O-N 3.46Å
215	N	76.5	Confident	76.4	Confident	69 Å²	69	93.9 Å²	93.9	37%	0.369	47%	0.469	S	S	.	.	H	α-helix	trans	-62.2	-41	173	-77	-23.9	0	0	0	111.6	L211 E213 L218 I219	L211-N215 VanDerWaalsContact O-CB 3.3Å; L211-N215 WeakPolarHBondContact O-CB 3.38Å; L211-N215 PolarHBondContact O-N 3.48Å; L211-N215 VanDerWaalsContact O-N 3.11Å; L211-N215 PolarHBondContact O-ND2 3.3Å; L211-N215 VanDerWaalsContact O-ND2 3.12Å; E213-N215 VanDerWaalsContact C-N 3.35Å; E213-N215 PolarHBondContact O-N 3.3Å; N215-L218 PolarHBondContact O-N 3.1Å; N215-I219 VanDerWaalsContact O-CG1 3.3Å; N215-I219 WeakPolarHBondContact O-CG1 3.47Å; N215-I219 PolarHBondContact O-N 2.84Å
216	S	73.5	Confident	77.4	Confident	64 Å²	64	92.8 Å²	92.8	45%	0.448	46%	0.462	S	S	.	.	H	α-helix	trans	-68.6	-34.5	177.8	82.6	0	0	0	0	112.6	T212 E213 E214 S220	T212-S216 WeakPolarHBondContact O-CB 3.35Å; T212-S216 PolarHBondContact O-N 2.67Å; E213-S216 CarbonylContact O-C 3.54Å; E213-S216 WeakPolarHBondContact O-CA 3.29Å; E213-S216 WeakPolarHBondContact O-CB 3.4Å; E213-S216 PolarHBondContact O-N 3.12Å; E213-S216 PolarHBondContact O-OG 3.1Å; E214-S216 VanDerWaalsContact C-N 3.35Å; E214-S216 PolarHBondContact O-N 3.36Å; S216-S220 WeakPolarHBondContact O-CB 3.5Å; S216-S220 PolarHBondContact O-N 3.39Å; S216-S220 PolarHBondContact O-OG 3.1Å
217	E	79.1	Confident	77.7	Confident	97 Å²	97	90.7 Å²	90.7	45%	0.453	46%	0.458	S	S	.	.	H	α-helix	trans	-64.2	-43	170.8	-80.2	-153.5	173.4	0	0	111.4	E213 E214 S220 K221	E213-E217 PolarHBondContact O-N 3.34Å; E214-E217 PolarHBondContact O-N 3.2Å; E217-S220 WeakPolarHBondContact CA-OG 3.31Å; E217-S220 PolarHBondContact O-N 3.28Å; E217-S220 PolarHBondContact O-OG 3.3Å; E217-S220 VanDerWaalsContact O-OG 3.08Å; E217-K221 VanDerWaalsContact O-CB 3.28Å; E217-K221 WeakPolarHBondContact O-CB 3.5Å; E217-K221 VanDerWaalsContact O-CD 3.29Å; E217-K221 WeakPolarHBondContact O-CD 3.24Å; E217-K221 WeakPolarHBondContact O-CG 3.2Å; E217-K221 PolarHBondContact O-N 2.92Å; E217-K221 IonicContact OE2-NZ 2.88Å; E217-K221 PolarHBondContact OE2-NZ 3.47Å
218	L	80.6	Confident	78.1	Confident	106 Å²	106	94.8 Å²	94.8	56%	0.555	48%	0.478	S	S	*	.	H	α-helix	trans	-64.2	-43.8	177	-72.2	168.6	0	0	0	111.6	E214 N215 K221 L222	E214-L218 WeakPolarHBondContact O-CG 3.23Å; E214-L218 PolarHBondContact O-N 3.46Å; N215-L218 PolarHBondContact O-N 3.1Å; L218-K221 PolarHBondContact O-N 2.92Å; L218-L222 WeakPolarHBondContact O-CB 3.41Å; L218-L222 PolarHBondContact O-N 3.47Å
219	I	80	Confident	78.1	Confident	122 Å²	122	96.7 Å²	96.7	63%	0.626	48%	0.482	S	S	*	.	H	α-helix	trans	-63.9	-42.5	177	-68.6	164.5	0	0	0	111.3	N215 L222 W223	N215-I219 VanDerWaalsContact O-CG1 3.3Å; N215-I219 WeakPolarHBondContact O-CG1 3.47Å; N215-I219 PolarHBondContact O-N 2.84Å; I219-L222 PolarHBondContact O-N 2.86Å; I219-W223 WeakPolarHBondContact O-CB 3.39Å; I219-W223 PolarHBondContact O-N 2.83Å
220	S	82.5	Confident	78	Confident	60 Å²	60	94.6 Å²	94.6	42%	0.42	47%	0.474	S	S	.	.	H	α-helix	trans	-72.4	-33.4	178.5	56.4	0	0	0	0	113.3	S216 E217 T224	S216-S220 WeakPolarHBondContact O-CB 3.5Å; S216-S220 PolarHBondContact O-N 3.39Å; S216-S220 PolarHBondContact O-OG 3.1Å; E217-S220 WeakPolarHBondContact CA-OG 3.31Å; E217-S220 PolarHBondContact O-N 3.28Å; E217-S220 PolarHBondContact O-OG 3.3Å; E217-S220 VanDerWaalsContact O-OG 3.08Å; S220-T224 WeakPolarHBondContact O-CB 3.09Å; S220-T224 WeakPolarHBondContact O-CG2 3.34Å; S220-T224 PolarHBondContact O-N 3.36Å; S220-T224 PolarHBondContact O-OG1 2.9Å
221	K	85.6	Confident	77.5	Confident	112 Å²	112	92.7 Å²	92.7	49%	0.487	48%	0.476	S	S	.	.	H	α-helix	trans	-65.2	-43.4	170	-72.7	162.9	-166.4	167.9	0	111.5	E217 L218 T224 D225	E217-K221 VanDerWaalsContact O-CB 3.28Å; E217-K221 WeakPolarHBondContact O-CB 3.5Å; E217-K221 VanDerWaalsContact O-CD 3.29Å; E217-K221 WeakPolarHBondContact O-CD 3.24Å; E217-K221 WeakPolarHBondContact O-CG 3.2Å; E217-K221 PolarHBondContact O-N 2.92Å; E217-K221 IonicContact OE2-NZ 2.88Å; E217-K221 PolarHBondContact OE2-NZ 3.47Å; L218-K221 PolarHBondContact O-N 2.92Å; K221-T224 WeakPolarHBondContact CA-OG1 3.21Å; K221-T224 PolarHBondContact O-N 2.79Å; K221-T224 PolarHBondContact O-OG1 3.13Å; K221-T224 VanDerWaalsContact O-OG1 3.08Å; K221-D225 PolarHBondContact O-N 3Å
222	L	86	Confident	76.9	Confident	107 Å²	107	96.6 Å²	96.6	56%	0.56	50%	0.501	S	S	*	.	H	α-helix	trans	-64.1	-43.5	174.9	-178.1	61.3	0	0	0	111.7	L218 I219 T224 D225 I226	L218-L222 WeakPolarHBondContact O-CB 3.41Å; L218-L222 PolarHBondContact O-N 3.47Å; I219-L222 PolarHBondContact O-N 2.86Å; L222-T224 PolarHBondContact O-N 2.86Å; L222-D225 PolarHBondContact O-N 3.39Å; L222-I226 HydrophobicContact CD1-CD1 4.24Å; L222-I226 HydrophobicContact CG-CD1 4.03Å; L222-I226 WeakPolarHBondContact O-CD1 3.4Å; L222-I226 VanDerWaalsContact O-CG1 3.27Å; L222-I226 WeakPolarHBondContact O-CG1 3.22Å; L222-I226 PolarHBondContact O-N 3.15Å
223	W	75.3	Confident	75.9	Confident	161 Å²	161	100.1 Å²	100.1	61%	0.61	51%	0.511	S	S	*	.	H	α-helix	trans	-61.8	-42.7	176	-174.6	-105.3	0	0	0	111.9	I219 I226 Q227	I219-W223 WeakPolarHBondContact O-CB 3.39Å; I219-W223 PolarHBondContact O-N 2.83Å; W223-I226 PolarHBondContact O-N 3.45Å; W223-Q227 VanDerWaalsContact O-CG 3.27Å; W223-Q227 WeakPolarHBondContact O-CG 3.4Å; W223-Q227 PolarHBondContact O-N 3.11Å
224	T	83	Confident	74.3	Confident	74 Å²	74	99.2 Å²	99.2	45%	0.454	52%	0.518	S	S	.	.	H	α-helix	trans	-70.7	-33.8	178.4	47.1	0	0	0	0	113.3	S220 K221 L222 Q227 Q228	S220-T224 WeakPolarHBondContact O-CB 3.09Å; S220-T224 WeakPolarHBondContact O-CG2 3.34Å; S220-T224 PolarHBondContact O-N 3.36Å; S220-T224 PolarHBondContact O-OG1 2.9Å; K221-T224 WeakPolarHBondContact CA-OG1 3.21Å; K221-T224 PolarHBondContact O-N 2.79Å; K221-T224 PolarHBondContact O-OG1 3.13Å; K221-T224 VanDerWaalsContact O-OG1 3.08Å; L222-T224 PolarHBondContact O-N 2.86Å; T224-Q227 PolarHBondContact O-N 2.94Å; T224-Q228 WeakPolarHBondContact O-CG 3.27Å; T224-Q228 PolarHBondContact O-N 3.4Å
225	D	82.4	Confident	73	Confident	89 Å²	89	103.8 Å²	103.8	48%	0.476	54%	0.539	S	S	.	.	H	α-helix	trans	-62.4	-48	169.4	-176.7	72	0	0	0	111.5	K221 L222 Q227 Q228 K229	K221-D225 PolarHBondContact O-N 3Å; L222-D225 PolarHBondContact O-N 3.39Å; D225-Q227 VanDerWaalsContact C-N 3.32Å; D225-Q227 PolarHBondContact O-N 2.95Å; D225-Q228 PolarHBondContact O-N 2.95Å; D225-Q228 VanDerWaalsContact O-N 3.15Å; D225-K229 WeakPolarHBondContact O-CB 3.32Å; D225-K229 PolarHBondContact O-N 2.99Å
226	I	86.1	Confident	71.2	Confident	69 Å²	69	106.8 Å²	106.8	35%	0.354	56%	0.559	S	S	.	*	H	α-helix	trans	-56.4	-45.9	176.5	-70.3	165.4	0	0	0	110.9	L222 W223 K229 I230	L222-I226 HydrophobicContact CD1-CD1 4.24Å; L222-I226 HydrophobicContact CG-CD1 4.03Å; L222-I226 WeakPolarHBondContact O-CD1 3.4Å; L222-I226 VanDerWaalsContact O-CG1 3.27Å; L222-I226 WeakPolarHBondContact O-CG1 3.22Å; L222-I226 PolarHBondContact O-N 3.15Å; W223-I226 PolarHBondContact O-N 3.45Å; I226-K229 WeakPolarHBondContact O-CB 3.39Å; I226-K229 PolarHBondContact O-N 3.37Å; I226-I230 HydrophobicContact CG2-CD1 3.94Å; I226-I230 WeakPolarHBondContact O-CG1 3.27Å; I226-I230 PolarHBondContact O-N 3.14Å
227	Q	77.1	Confident	69.2	Low	85 Å²	85	110 Å²	110	40%	0.397	58%	0.577	S	S	.	*	H	α-helix	trans	-66.5	-38.2	178	-65.9	-63.8	-26.6	0	0	112.6	W223 T224 D225 K229 I230 A231	W223-Q227 VanDerWaalsContact O-CG 3.27Å; W223-Q227 WeakPolarHBondContact O-CG 3.4Å; W223-Q227 PolarHBondContact O-N 3.11Å; T224-Q227 PolarHBondContact O-N 2.94Å; D225-Q227 VanDerWaalsContact C-N 3.32Å; D225-Q227 PolarHBondContact O-N 2.95Å; Q227-K229 VanDerWaalsContact C-N 3.33Å; Q227-K229 PolarHBondContact O-N 3.3Å; Q227-I230 PolarHBondContact O-N 3.32Å; Q227-A231 WeakPolarHBondContact O-CB 3.4Å; Q227-A231 PolarHBondContact O-N 2.92Å
228	Q	74.3	Confident	67.4	Low	132 Å²	132	110.9 Å²	110.9	62%	0.617	59%	0.591	S	S	*	*	H	α-helix	trans	-65.8	-35.2	172.9	-74.9	-173.8	27.7	0	0	112.4	T224 D225 A231 T232	T224-Q228 WeakPolarHBondContact O-CG 3.27Å; T224-Q228 PolarHBondContact O-N 3.4Å; D225-Q228 PolarHBondContact O-N 2.95Å; D225-Q228 VanDerWaalsContact O-N 3.15Å; Q228-A231 PolarHBondContact O-N 3.32Å; Q228-T232 WeakPolarHBondContact O-CB 3.28Å; Q228-T232 WeakPolarHBondContact O-CG2 3.46Å; Q228-T232 PolarHBondContact O-N 3.07Å; Q228-T232 PolarHBondContact O-OG1 2.87Å
229	K	73.1	Confident	65.9	Low	143 Å²	143	112 Å²	112	62%	0.622	60%	0.604	S	S	*	*	H	α-helix	trans	-67.2	-39.1	177.4	-158.4	171.2	-173.3	173.4	0	112	D225 I226 Q227 T232 Q233	D225-K229 WeakPolarHBondContact O-CB 3.32Å; D225-K229 PolarHBondContact O-N 2.99Å; I226-K229 WeakPolarHBondContact O-CB 3.39Å; I226-K229 PolarHBondContact O-N 3.37Å; Q227-K229 VanDerWaalsContact C-N 3.33Å; Q227-K229 PolarHBondContact O-N 3.3Å; K229-T232 WeakPolarHBondContact CA-OG1 3.44Å; K229-T232 PolarHBondContact O-OG1 3.43Å; K229-Q233 WeakPolarHBondContact O-CB 3.49Å; K229-Q233 PolarHBondContact O-N 2.91Å
230	I	70.8	Confident	63.3	Low	86 Å²	86	110 Å²	110	44%	0.441	61%	0.613	S	S	.	*	H	α-helix	trans	-67	-44.7	172.6	-66	163	0	0	0	110.8	I226 Q227 Q233 S234	I226-I230 HydrophobicContact CG2-CD1 3.94Å; I226-I230 WeakPolarHBondContact O-CG1 3.27Å; I226-I230 PolarHBondContact O-N 3.14Å; Q227-I230 PolarHBondContact O-N 3.32Å; I230-Q233 PolarHBondContact O-N 2.85Å; I230-S234 PolarHBondContact O-OG 3.25Å; I230-S234 VanDerWaalsContact O-OG 3.12Å
231	A	65.2	Low	60.8	Low	63 Å²	63	113.6 Å²	113.6	52%	0.521	63%	0.633	S	S	.	*	H	α-helix	trans	-63.9	-41.7	178.9	0	0	0	0	0	112.8	Q227 Q228 S234	Q227-A231 WeakPolarHBondContact O-CB 3.4Å; Q227-A231 PolarHBondContact O-N 2.92Å; Q228-A231 PolarHBondContact O-N 3.32Å; A231-S234 PolarHBondContact O-N 3.21Å
232	T	58.4	Low	58.9	Low	104 Å²	104	114.3 Å²	114.3	64%	0.638	65%	0.649	S	S	*	*	H	α-helix	trans	-71.8	-28.6	179	47.4	0	0	0	0	113.3	Q228 K229 S234	Q228-T232 WeakPolarHBondContact O-CB 3.28Å; Q228-T232 WeakPolarHBondContact O-CG2 3.46Å; Q228-T232 PolarHBondContact O-N 3.07Å; Q228-T232 PolarHBondContact O-OG1 2.87Å; K229-T232 WeakPolarHBondContact CA-OG1 3.44Å; K229-T232 PolarHBondContact O-OG1 3.43Å; T232-S234 PolarHBondContact O-N 3.4Å
233	Q	50.3	Low	56	Low	166 Å²	166	114.2 Å²	114.2	78%	0.776	66%	0.657	S	S	*	*	H	α-helix	trans	-66.7	-20.1	173	-167.5	169	25.3	0	0	113.1	K229 I230 Q235	K229-Q233 WeakPolarHBondContact O-CB 3.49Å; K229-Q233 PolarHBondContact O-N 2.91Å; I230-Q233 PolarHBondContact O-N 2.85Å; Q233-Q235 PolarHBondContact O-N 2.93Å
234	S	46.6	Very low	54.6	Low	99 Å²	99	111.9 Å²	111.9	69%	0.692	66%	0.663	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.4	8.3	-174.2	-57.7	0	0	0	0	114.9	I230 A231 T232	I230-S234 PolarHBondContact O-OG 3.25Å; I230-S234 VanDerWaalsContact O-OG 3.12Å; A231-S234 PolarHBondContact O-N 3.21Å; T232-S234 PolarHBondContact O-N 3.4Å
235	Q	46.3	Very low	51.8	Low	172 Å²	172	113.2 Å²	113.2	80%	0.804	68%	0.682	S	S	*	*			trans	-124.7	55	-167.7	-160.5	167.4	90.7	0	0	114.8	Q233	Q233-Q235 PolarHBondContact O-N 2.93Å
236	V	38.2	Very low	49.1	Very low	131 Å²	131	117 Å²	117	79%	0.794	70%	0.701	S	S	*	*			trans	-135.7	80.1	171	-171.9	0	0	0	0	111.8
237	T	32.8	Very low	46.3	Very low	133 Å²	133	119.6 Å²	119.6	82%	0.816	73%	0.725	S	S	*	*			trans	-168.7	139.6	159	-77.9	0	0	0	0	109.6
238	P	41.3	Very low	43.9	Very low	115 Å²	115	121.5 Å²	121.5	75%	0.747	75%	0.748	S	S	*	*			trans	-83.1	169.8	-179.9	33.5	-36.2	0	0	0	114.7
239	P	49.2	Very low	41.7	Very low	130 Å²	130	118.3 Å²	118.3	84%	0.844	75%	0.75	S	S	*	*			trans	-104.9	166.1	-153.7	39.7	-37.2	0	0	0	117.2
240	G	25.7	Very low	39.7	Very low	78 Å²	78	118.7 Å²	118.7	80%	0.804	75%	0.754	S	S	*	*			trans	-151.2	145.1	163.6	0	0	0	0	0	112
241	T	30.2	Very low	37.9	Very low	136 Å²	136	120.8 Å²	120.8	83%	0.834	76%	0.762	S	S	*	*			trans	-130.7	158.9	-174.3	-9.3	0	0	0	0	107.8
242	P	45.4	Very low	36.5	Very low	127 Å²	127	128.2 Å²	128.2	83%	0.825	78%	0.777	S	S	*	*			cis	-142.2	-176.9	38.4	40.7	-19.1	0	0	0	118.5
243	S	23.5	Very low	35.5	Very low	105 Å²	105	128.3 Å²	128.3	73%	0.734	79%	0.788	S	S	*	*			trans	-86.8	-169.4	175.3	-142.6	0	0	0	0	111
244	P	46.2	Very low	34.5	Very low	113 Å²	113	125.5 Å²	125.5	73%	0.734	79%	0.793	S	S	*	*			cis	-142.3	172.2	-0.3	42.7	-24.3	0	0	0	118.2
245	A	23.8	Very low	33.9	Very low	102 Å²	102	128.2 Å²	128.2	84%	0.843	80%	0.799	S	S	*	*			trans	-159.7	158.7	146.5	0	0	0	0	0	111
246	L	27	Very low	33.3	Very low	169 Å²	169	127.4 Å²	127.4	89%	0.885	80%	0.8	S	S	*	*			trans	-128.4	145.1	-175.2	-75.3	134	0	0	0	113
247	S	27.2	Very low	33.1	Very low	123 Å²	123	126.2 Å²	126.2	86%	0.86	80%	0.804	S	S	*	*			trans	153.4	157.8	148.1	48.9	0	0	0	0	109.7
248	S	27.1	Very low	33.8	Very low	125 Å²	125	125.8 Å²	125.8	87%	0.874	80%	0.801	S	S	*	*			cis	-173.5	161.1	-28.1	-172.8	0	0	0	0	106.6
249	G	27.9	Very low	33.9	Very low	64 Å²	64	127.5 Å²	127.5	66%	0.66	80%	0.804	S	S	*	*			trans	114	117.4	160.7	0	0	0	0	0	118.3
250	E	30.6	Very low	33.2	Very low	152 Å²	152	125.6 Å²	125.6	71%	0.71	80%	0.8	S	S	*	*			trans	15.2	110.2	146.9	-87.8	40.3	-119.9	0	0	121.5
251	Q	32.6	Very low	33.5	Very low	129 Å²	129	128.5 Å²	128.5	60%	0.603	80%	0.801	S	S	*	*				49.1	138.8	102.3	-69.9	-171.4	63.6	0	0	122.5
252	R	35.8	Very low	34	Very low	220 Å²	220	131.3 Å²	131.3	83%	0.83	80%	0.802	S	S	*	*			trans	79.9	95.6	148.5	-68.6	162.4	-163.8	-126.9	3.1	120
253	A	38.7	Very low	33.5	Very low	106 Å²	106	135 Å²	135	88%	0.876	80%	0.8	S	S	*	*				15.6	123.7	124.9	0	0	0	0	0	120
254	A	29.5	Very low	34.1	Very low	107 Å²	107	138.4 Å²	138.4	88%	0.884	81%	0.809	S	S	*	*			trans	-148.5	160.2	151.4	0	0	0	0	0	111.1
255	L	33.2	Very low	33.5	Very low	155 Å²	155	141 Å²	141	81%	0.812	81%	0.811	S	S	*	*			trans	-84.2	159.8	-174.2	-66.7	151.6	0	0	0	113.3
256	N	34	Very low	34	Very low	156 Å²	156	142.8 Å²	142.8	83%	0.834	81%	0.811	S	S	*	*			trans	34.7	118.6	146.8	-63.3	-18.1	0	0	0	120.6
257	A	34	Very low	34	Very low	106 Å²	106	145.5 Å²	145.5	88%	0.876	81%	0.81	S	S	*	*			trans	-148.7	144.1	145.6	0	0	0	0	0	111.5
258	T	47.6	Very low	34.1	Very low	123 Å²	123	147.3 Å²	147.3	76%	0.755	81%	0.809	S	S	*	*			trans	-108.1	173.9	174.4	46.5	0	0	0	0	111.5
259	N	43.1	Very low	34.1	Very low	151 Å²	151	149.5 Å²	149.5	81%	0.807	81%	0.805	S	S	*	*			trans	86.5	122.2	171.6	-54.4	-68	0	0	0	118.5
260	A	34	Very low	34.9	Very low	91 Å²	91	151.4 Å²	151.4	75%	0.752	81%	0.806	S	S	*	*			trans	-161.6	91.6	139.1	0	0	0	0	0	110.5	K262	A260-K262 PolarHBondContact O-N 2.71Å
261	V	31.9	Very low	34.6	Very low	138 Å²	138	153.2 Å²	153.2	84%	0.836	82%	0.815	S	S	*	*			trans	-74.6	123.3	170.9	174.5	0	0	0	0	109.4
262	K	40.9	Very low	34.5	Very low	196 Å²	196	155.7 Å²	155.7	85%	0.852	83%	0.826	S	S	*	*			trans	-94.8	106.6	174.5	-72.2	-172.6	177.7	-179.7	0	111.4	A260	A260-K262 PolarHBondContact O-N 2.71Å
263	R	34.1	Very low	34.3	Very low	205 Å²	205	150.2 Å²	150.2	77%	0.774	82%	0.822	S	S	*	*			trans	-70.3	138	162	-72.3	164.9	58.5	-176.4	-1.1	109.6
264	L	36.2	Very low	33.8	Very low	176 Å²	176	151.5 Å²	151.5	92%	0.921	82%	0.819	S	S	*	*			trans	-135.9	133.8	152.8	-74.9	178.9	0	0	0	109.1
265	Q	34.1	Very low	33.7	Very low	166 Å²	166	154.6 Å²	154.6	78%	0.776	82%	0.815	S	S	*	*			trans	-119.4	135.8	167.9	-76.4	176.2	-70.9	0	0	108.3
266	T	33.6	Very low	33.4	Very low	140 Å²	140	153 Å²	153	86%	0.859	81%	0.812	S	S	*	*			trans	-134.8	107.2	157	46.9	0	0	0	0	105.4
267	R	28.7	Very low	33.1	Very low	226 Å²	226	153.3 Å²	153.3	85%	0.853	81%	0.813	S	S	*	*				71.2	89.5	58.9	-166.2	-166.2	-169.4	-139.4	1.9	112.1
268	L	28.9	Very low	32.8	Very low	162 Å²	162	155.7 Å²	155.7	85%	0.848	81%	0.811	S	S	*	*				-166.5	170.4	123.1	-98.6	161.3	0	0	0	110.2
269	Q	27.4	Very low	31.9	Very low	170 Å²	170	154.4 Å²	154.4	79%	0.794	81%	0.807	S	S	*	*			trans	-136.9	-177.7	-170	-85.1	-82.1	43.6	0	0	107.3
270	P	44.7	Very low	31.3	Very low	105 Å²	105	152.7 Å²	152.7	68%	0.682	81%	0.806	S	S	*	*			cis	-129.4	-178.3	-39	38.2	-23.4	0	0	0	111.6
271	E	24.5	Very low	31.1	Very low	190 Å²	190	158.7 Å²	158.7	89%	0.888	81%	0.811	S	S	*	*				-169.9	171.4	119.8	-132	177.4	-179.5	0	0	111.6
272	E	28.7	Very low	31.3	Very low	181 Å²	181	158 Å²	158	85%	0.846	81%	0.807	S	S	*	*			trans	-131.1	169.5	-171.9	-64.9	-173.6	119.2	0	0	113.4
273	S	32.8	Very low	30.9	Very low	105 Å²	105	154.6 Å²	154.6	73%	0.734	80%	0.803	S	S	*	*			trans	103.9	120	146.8	76.7	0	0	0	0	121.9
274	T	27.8	Very low	30.8	Very low	132 Å²	132	148.7 Å²	148.7	81%	0.81	81%	0.805	S	S	*	*			trans	86	144.4	134.4	39.6	0	0	0	0	125
275	E	27.6	Very low	30.6	Very low	172 Å²	172	148.1 Å²	148.1	80%	0.804	80%	0.798	S	S	*	*			trans	71.3	83.8	155.6	-69.5	-175.2	151.2	0	0	122.8
276	T	25.6	Very low	30.3	Very low	122 Å²	122	145.6 Å²	145.6	75%	0.748	79%	0.793	S	S	*	*				48.5	141.7	113.2	55.6	0	0	0	0	123.7
277	L	29.8	Very low	30.2	Very low	162 Å²	162	146.2 Å²	146.2	85%	0.848	79%	0.79	S	S	*	*			trans	91.8	89.2	155.6	-73.9	164.6	0	0	0	120.1
278	D	25.8	Very low	30.1	Very low	156 Å²	156	143.1 Å²	143.1	83%	0.834	79%	0.791	S	S	*	*				95.5	159.9	119.6	-150.2	13.9	0	0	0	120.1
279	S	30	Very low	30.4	Very low	97 Å²	97	140.1 Å²	140.1	68%	0.678	78%	0.784	S	S	*	*			trans	77.8	80.9	173.9	-151	0	0	0	0	119.4
280	S	30.4	Very low	30.8	Very low	114 Å²	114	142.2 Å²	142.2	80%	0.797	78%	0.784	S	S	*	*			trans	92.3	135.1	135.5	80.6	0	0	0	0	122.3
281	Y	29.6	Very low	30.4	Very low	217 Å²	217	146.4 Å²	146.4	85%	0.851	79%	0.792	S	S	*	*			trans	72.1	60.6	156.4	-132.6	-88.7	0	0	0	122.4
282	V	34.9	Very low	30.7	Very low	125 Å²	125	145 Å²	145	76%	0.758	79%	0.785	S	S	*	*				31.7	116.8	128.5	-175.7	0	0	0	0	119.2
283	V	32.6	Very low	31	Very low	124 Å²	124	146 Å²	146	75%	0.752	79%	0.786	S	S	*	*			trans	-70.1	133.3	162.1	172.4	0	0	0	0	111.5
284	G	32.1	Very low	31.1	Very low	80 Å²	80	149.3 Å²	149.3	83%	0.825	79%	0.79	S	S	*	*			trans	-119.9	86.5	173.8	0	0	0	0	0	112.8
285	H	32.3	Very low	31.2	Very low	165 Å²	165	151 Å²	151	76%	0.764	79%	0.794	S	S	*	*			trans	-88.7	148.5	176	-118.8	-88.1	0	0	0	111.8
286	V	29	Very low	31.6	Very low	113 Å²	113	148.6 Å²	148.6	69%	0.685	79%	0.786	S	S	*	*	S	Bend	trans	72.7	124.7	155.7	176.8	0	0	0	0	118.3
287	L	31.4	Very low	31.8	Very low	153 Å²	153	150.9 Å²	150.9	80%	0.801	79%	0.793	S	S	*	*			trans	36	124.9	154.1	-61.1	167.8	0	0	0	119.6
288	N	26.7	Very low	32.1	Very low	160 Å²	160	151.5 Å²	151.5	86%	0.856	79%	0.789	S	S	*	*				-161.7	145.8	118.4	-110.3	-75.6	0	0	0	112.1
289	S	35.1	Very low	32.3	Very low	100 Å²	100	150.2 Å²	150.2	70%	0.699	79%	0.787	S	S	*	*			trans	-87	176.5	159.2	61.8	0	0	0	0	110
290	R	34.4	Very low	32.4	Very low	214 Å²	214	153.5 Å²	153.5	81%	0.808	79%	0.789	S	S	*	*			trans	70.7	121.6	165.3	-161.4	-176.1	-167	178.8	7.9	116.6
291	K	36.8	Very low	32.3	Very low	193 Å²	193	158.5 Å²	158.5	84%	0.839	79%	0.79	S	S	*	*				-168.8	116	115.8	-99.3	149.3	-163.9	169.3	0	115.6
292	Q	31.7	Very low	32.6	Very low	159 Å²	159	157.2 Å²	157.2	74%	0.743	79%	0.789	S	S	*	*			trans	-40	142.6	145.4	176.1	-174.8	13.5	0	0	112.6
293	K	33.9	Very low	33.2	Very low	202 Å²	202	156.2 Å²	156.2	88%	0.878	79%	0.785	S	S	*	*			trans	-95.3	142.9	166.5	-72	-178	177.9	176.9	0	110.7
294	Q	34.8	Very low	32.9	Very low	175 Å²	175	156.6 Å²	156.6	82%	0.818	78%	0.783	S	S	*	*			trans	-104.1	163.1	165.9	-72	-178.8	-22.9	0	0	110.1
295	L	31.2	Very low	32.8	Very low	168 Å²	168	159.3 Å²	159.3	88%	0.88	78%	0.778	S	S	*	*			trans	-129.3	153.6	151.2	-104.9	169.1	0	0	0	109.4
296	L	35	Very low	32.7	Very low	122 Å²	122	159.7 Å²	159.7	64%	0.639	78%	0.779	S	S	*	*			trans	-91.1	163.1	-164.2	-61.3	88.5	0	0	0	112.8
297	N	30.1	Very low	32.5	Very low	169 Å²	169	158 Å²	158	90%	0.904	78%	0.777	S	S	*	*				-152.8	161.6	113.4	-101.9	-38.2	0	0	0	113.1
298	K	35.6	Very low	32.3	Very low	176 Å²	176	158.8 Å²	158.8	77%	0.765	78%	0.781	S	S	*	*			trans	-105.7	166.7	-177.1	-62.4	176.1	179.3	175.9	0	110.6
299	V	30.5	Very low	32.5	Very low	129 Å²	129	156.3 Å²	156.3	78%	0.782	78%	0.776	S	S	*	*			trans	147.5	102.2	132.8	167.5	0	0	0	0	114
300	K	32	Very low	32.7	Very low	165 Å²	165	160.9 Å²	160.9	72%	0.717	78%	0.783	S	S	*	*				65.5	132.6	122.9	-157.8	174.6	-176.2	176.1	0	122.3
301	R	28.2	Very low	33.4	Very low	219 Å²	219	156.2 Å²	156.2	83%	0.826	78%	0.781	S	S	*	*			trans	83.4	120.2	153.5	-91.2	172.1	179	162.2	-3.3	121.2
302	K	37	Very low	33.1	Very low	191 Å²	191	156 Å²	156	83%	0.83	78%	0.78	S	S	*	*			trans	-78.4	177.7	149.4	-73.1	-164.7	177.6	-169.7	0	109.7
303	P	46.8	Very low	33.2	Very low	103 Å²	103	156.6 Å²	156.6	67%	0.669	78%	0.78	S	S	*	*			cis	-145.4	174.5	18.5	44.4	-25	0	0	0	119.6
304	N	26.1	Very low	32.8	Very low	132 Å²	132	153.5 Å²	153.5	71%	0.706	77%	0.773	S	S	*	*			trans	38.8	145.7	143	-52.4	-4.3	0	0	0	121.3
305	L	30.4	Very low	32.6	Very low	138 Å²	138	151.1 Å²	151.1	72%	0.723	76%	0.764	S	S	*	*				-178.3	152.1	73.4	-82.6	170	0	0	0	113.1
306	H	29.8	Very low	32.8	Very low	173 Å²	173	150.1 Å²	150.1	80%	0.801	76%	0.759	S	S	*	*			trans	58.6	154.8	147.8	-67.9	-43.2	0	0	0	122.3
307	A	24.9	Very low	32.7	Very low	76 Å²	76	149.8 Å²	149.8	63%	0.628	77%	0.767	S	S	*	*			cis	-170.7	169.3	-20.4	0	0	0	0	0	112.9
308	L	27.9	Very low	32.7	Very low	170 Å²	170	145.2 Å²	145.2	89%	0.89	76%	0.759	S	S	*	*			trans	68.9	156.5	162.1	-101.4	61.5	0	0	0	117.9
309	S	30.1	Very low	32.5	Very low	108 Å²	108	142.6 Å²	142.6	76%	0.755	76%	0.763	S	S	*	*			cis	-144.6	168.9	-0.1	56	0	0	0	0	113.2
310	K	38.6	Very low	32.7	Very low	196 Å²	196	142.9 Å²	142.9	85%	0.852	77%	0.765	S	S	*	*			trans	-104.3	-164.9	178.8	-49.6	-176.8	-179.3	-179.5	0	110.2
311	P	49.1	Very low	32.8	Very low	117 Å²	117	141 Å²	141	76%	0.76	77%	0.767	S	S	*	*			cis	-135.6	-174.3	-6.7	39	-16.7	0	0	0	114.8
312	K	30.7	Very low	33.2	Very low	189 Å²	189	136.3 Å²	136.3	82%	0.822	77%	0.769	S	S	*	*				169.1	117.7	81.3	-178.2	175.6	179.7	-178.6	0	114.6
313	K	34	Very low	33	Very low	170 Å²	170	132.1 Å²	132.1	74%	0.739	77%	0.77	S	S	*	*			trans	57	142.1	155	-74	-167.3	173	-169.1	0	119.2
314	N	26.3	Very low	32.5	Very low	138 Å²	138	134.7 Å²	134.7	74%	0.738	78%	0.778	S	S	*	*			cis	-137.4	151.6	39.4	-90.9	-35.4	0	0	0	115.9
315	M	30.2	Very low	33.1	Very low	125 Å²	125	136 Å²	136	62%	0.616	78%	0.784	S	S	*	*			trans	29.6	113.3	144.1	-47.9	-67.4	77	0	0	119.7
316	L	35	Very low	33.9	Very low	147 Å²	147	134.4 Å²	134.4	77%	0.77	78%	0.782	S	S	*	*				68.4	130.2	80.2	-70.4	176.7	0	0	0	113.3
317	S	32.9	Very low	35.1	Very low	115 Å²	115	133.1 Å²	133.1	80%	0.804	78%	0.781	S	S	*	*			cis	-146.7	173.8	11.6	-73.5	0	0	0	0	110.2
318	G	30.3	Very low	36.1	Very low	73 Å²	73	140.9 Å²	140.9	75%	0.753	79%	0.794	S	S	*	*			cis	-166.1	-172.6	4.8	0	0	0	0	0	111.9
319	S	32.1	Very low	36.9	Very low	121 Å²	121	138.5 Å²	138.5	85%	0.846	79%	0.787	S	S	*	*			trans	-122.1	151	-163.1	-47.1	0	0	0	0	114.9
320	T	34.3	Very low	38.1	Very low	134 Å²	134	139.7 Å²	139.7	82%	0.822	78%	0.784	S	S	*	*			trans	-148.7	120.4	150.5	9	0	0	0	0	113.3
321	T	33.8	Very low	39.4	Very low	125 Å²	125	132.4 Å²	132.4	77%	0.767	76%	0.759	S	S	*	*			trans	42.7	97.2	145.8	55.9	0	0	0	0	121.3
322	S	36.3	Very low	40.6	Very low	122 Å²	122	133.9 Å²	133.9	85%	0.853	76%	0.76	S	S	*	*				41.3	104.5	110.4	176.7	0	0	0	0	119.6
323	A	33.2	Very low	42.9	Very low	103 Å²	103	127.8 Å²	127.8	85%	0.851	74%	0.736	S	S	*	*			trans	-148.7	126.3	132.5	0	0	0	0	0	109.3
324	D	37.2	Very low	45.2	Very low	156 Å²	156	123.8 Å²	123.8	83%	0.834	72%	0.723	S	S	*	*			trans	-104.7	122.9	177.2	-172.1	7.5	0	0	0	109.2
325	L	37.4	Very low	47.9	Very low	160 Å²	160	120.6 Å²	120.6	84%	0.838	71%	0.708	S	S	*	*			trans	-154	122.8	168.3	-161.3	72.7	0	0	0	111.4	N327	L325-N327 PolarHBondContact O-N 3.46Å
326	P	48.7	Very low	50.5	Low	105 Å²	105	118.1 Å²	118.1	68%	0.682	70%	0.697	S	S	*	*			trans	-82.5	121.8	-176.2	30.8	-34	0	0	0	112.9	R328	P326-R328 PolarHBondContact O-N 2.8Å
327	N	54.9	Low	52.7	Low	146 Å²	146	115.1 Å²	115.1	78%	0.781	68%	0.678	S	S	*	*			trans	32.3	79.9	139.9	-174.5	17	0	0	0	116.8	L325	L325-N327 PolarHBondContact O-N 3.46Å
328	R	45.3	Very low	55.2	Low	238 Å²	238	115 Å²	115	90%	0.898	66%	0.664	S	S	*	*			trans	-151.4	41.4	167.7	-142.8	-168.7	175.7	-165.4	-3.3	118.8	P326	P326-R328 PolarHBondContact O-N 2.8Å
329	T	44.9	Very low	57.7	Low	121 Å²	121	116.6 Å²	116.6	74%	0.742	65%	0.653	S	S	*	*			trans	-146.4	118	147.9	43.3	0	0	0	0	108.8	S331	T329-S331 PolarHBondContact O-N 3.33Å; T329-S331 VanDerWaalsContact O-N 3.15Å
330	N	55.8	Low	60.3	Low	132 Å²	132	111.2 Å²	111.2	71%	0.706	62%	0.615	S	S	*	*			trans	-65	110.7	155.6	-54.8	-21.6	0	0	0	104.9	V335	N330-V335 HydrophobicContact CB-CG2 4.29Å
331	S	65.6	Low	62.7	Low	44 Å²	44	108.4 Å²	108.4	31%	0.308	59%	0.592	S	S	.	*			trans	-70.9	151.4	174.5	78.4	0	0	0	0	108.6	T329 L333 D334 V335	T329-S331 PolarHBondContact O-N 3.33Å; T329-S331 VanDerWaalsContact O-N 3.15Å; S331-L333 PolarHBondContact O-N 2.93Å; S331-L333 PolarHBondContact OG-N 2.82Å; S331-D334 VanDerWaalsContact CB-OD2 3.22Å; S331-D334 WeakPolarHBondContact CB-OD2 3.28Å; S331-D334 PolarHBondContact N-OD2 3.1Å; S331-D334 PolarHBondContact O-N 3.42Å; S331-D334 PolarHBondContact OG-N 3.45Å; S331-D334 PolarHBondContact OG-OD2 3.25Å; S331-V335 PolarHBondContact O-N 3.39Å
332	N	73.5	Confident	65.2	Low	147 Å²	147	107.1 Å²	107.1	79%	0.786	58%	0.577	S	S	*	*	H	α-helix	trans	-59.2	-22.2	176	-68.4	-13.9	0	0	0	111.8	L336	N332-L336 WeakPolarHBondContact O-CB 3.48Å; N332-L336 PolarHBondContact O-N 2.88Å; N332-L336 VanDerWaalsContact O-N 3.09Å
333	L	79.9	Confident	67.6	Low	61 Å²	61	104.4 Å²	104.4	32%	0.319	56%	0.556	S	S	.	*	H	α-helix	trans	-71.4	-39.4	173.2	-171	67.6	0	0	0	112.4	S331 L336 K337 L367 F370	S331-L333 PolarHBondContact O-N 2.93Å; S331-L333 PolarHBondContact OG-N 2.82Å; L333-L336 PolarHBondContact O-N 2.98Å; L333-K337 VanDerWaalsContact O-CB 3.28Å; L333-K337 WeakPolarHBondContact O-CB 3.43Å; L333-K337 PolarHBondContact O-N 3.17Å; L333-L367 HydrophobicContact CD1-CD1 3.83Å; L333-L367 HydrophobicContact CD2-CD1 3.69Å; L333-L367 HydrophobicContact CG-CD1 4.42Å; L333-F370 HydrophobicContact CD1-CD2 3.68Å; L333-F370 HydrophobicContact CD1-CE2 3.99Å; L333-F370 HydrophobicContact CD1-CG 4.23Å; L333-F370 HydrophobicContact CD2-CD2 4.49Å; L333-F370 HydrophobicContact CD2-CE2 4.06Å; L333-F370 HydrophobicContact CG-CD2 4.3Å; L333-F370 HydrophobicContact CG-CE2 4.1Å
334	D	81.4	Confident	70	Confident	87 Å²	87	100.8 Å²	100.8	47%	0.465	52%	0.521	S	S	.	.	H	α-helix	trans	-66.9	-38.5	176.5	-58	-57.6	0	0	0	111.5	S331 K337 H338	S331-D334 VanDerWaalsContact CB-OD2 3.22Å; S331-D334 WeakPolarHBondContact CB-OD2 3.28Å; S331-D334 PolarHBondContact N-OD2 3.1Å; S331-D334 PolarHBondContact O-N 3.42Å; S331-D334 PolarHBondContact OG-N 3.45Å; S331-D334 PolarHBondContact OG-OD2 3.25Å; D334-K337 PolarHBondContact O-N 3.5Å; D334-H338 PolarHBondContact O-N 3.38Å
335	V	84.4	Confident	72.3	Confident	71 Å²	71	97.6 Å²	97.6	43%	0.43	50%	0.501	S	S	.	.	H	α-helix	trans	-65	-47.4	175	-179.1	0	0	0	0	110.5	N330 S331 K337 H338 M339	N330-V335 HydrophobicContact CB-CG2 4.29Å; S331-V335 PolarHBondContact O-N 3.39Å; V335-K337 VanDerWaalsContact C-N 3.34Å; V335-K337 PolarHBondContact O-N 2.78Å; V335-H338 PolarHBondContact O-N 2.96Å; V335-M339 HydrophobicContact CG1-SD 4.41Å; V335-M339 WeakPolarHBondContact O-CG 3.39Å; V335-M339 PolarHBondContact O-N 3.12Å
336	L	82.8	Confident	74.6	Confident	72 Å²	72	95.2 Å²	95.2	38%	0.377	49%	0.486	S	S	.	.	H	α-helix	trans	-62	-41.2	176.1	179.4	60.5	0	0	0	111.9	N332 L333 H338 M339 I340	N332-L336 WeakPolarHBondContact O-CB 3.48Å; N332-L336 PolarHBondContact O-N 2.88Å; N332-L336 VanDerWaalsContact O-N 3.09Å; L333-L336 PolarHBondContact O-N 2.98Å; L336-H338 VanDerWaalsContact C-N 3.34Å; L336-H338 PolarHBondContact O-N 3.34Å; L336-M339 PolarHBondContact O-N 3.49Å; L336-I340 HydrophobicContact CD1-CD1 4.1Å; L336-I340 HydrophobicContact CD1-CG1 4.3Å; L336-I340 HydrophobicContact CG-CD1 3.89Å; L336-I340 WeakPolarHBondContact O-CB 3.3Å; L336-I340 VanDerWaalsContact O-CG1 3.28Å; L336-I340 WeakPolarHBondContact O-CG1 3.43Å; L336-I340 PolarHBondContact O-N 2.86Å
337	K	81.4	Confident	76.2	Confident	84 Å²	84	90.4 Å²	90.4	37%	0.365	45%	0.454	S	S	.	.	H	α-helix	trans	-59.3	-43.3	174.2	175.7	177.5	-176.1	-177.4	0	111.9	L333 D334 V335 I340 H341 F370	L333-K337 VanDerWaalsContact O-CB 3.28Å; L333-K337 WeakPolarHBondContact O-CB 3.43Å; L333-K337 PolarHBondContact O-N 3.17Å; D334-K337 PolarHBondContact O-N 3.5Å; V335-K337 VanDerWaalsContact C-N 3.34Å; V335-K337 PolarHBondContact O-N 2.78Å; K337-I340 PolarHBondContact O-N 3.03Å; K337-H341 VanDerWaalsContact CE-NE2 3.3Å; K337-H341 WeakPolarHBondContact CE-NE2 3.4Å; K337-H341 PolarHBondContact O-CD2 2.9Å; K337-H341 PolarHBondContact O-N 3.34Å; K337-F370 HydrophobicContact CB-CD1 4.3Å; K337-F370 HydrophobicContact CB-CE1 3.79Å; K337-F370 HydrophobicContact CB-CZ 4.46Å; K337-F370 HydrophobicContact CD-CE1 3.72Å; K337-F370 HydrophobicContact CD-CZ 4.01Å; K337-F370 HydrophobicContact CG-CD1 4.49Å; K337-F370 HydrophobicContact CG-CE1 3.7Å; K337-F370 HydrophobicContact CG-CZ 4.43Å
338	H	85.7	Confident	77.7	Confident	114 Å²	114	86 Å²	86	53%	0.528	43%	0.429	S	S	.	.	H	α-helix	trans	-62.5	-47	177.3	-173.4	-2	0	0	0	111.3	D334 V335 L336 I340 H341 E342	D334-H338 PolarHBondContact O-N 3.38Å; V335-H338 PolarHBondContact O-N 2.96Å; L336-H338 VanDerWaalsContact C-N 3.34Å; L336-H338 PolarHBondContact O-N 3.34Å; H338-I340 VanDerWaalsContact C-N 3.34Å; H338-I340 PolarHBondContact O-N 2.89Å; H338-H341 PolarHBondContact O-N 2.91Å; H338-E342 IonicContact CE1-OE1 2.84Å; H338-E342 PolarHBondContact CE1-OE1 3.42Å; H338-E342 IonicContact CE1-OE2 2.75Å; H338-E342 IonicContact ND1-OE2 3.27Å; H338-E342 WeakPolarHBondContact O-CG 3.42Å; H338-E342 PolarHBondContact O-N 3.46Å
339	M	84	Confident	79.5	Confident	106 Å²	106	78.2 Å²	78.2	52%	0.522	40%	0.403	S	S	.	.	H	α-helix	trans	-63.4	-37.3	177.8	-67.6	176.8	66.7	0	0	112.7	V335 L336 E342 V343	V335-M339 HydrophobicContact CG1-SD 4.41Å; V335-M339 WeakPolarHBondContact O-CG 3.39Å; V335-M339 PolarHBondContact O-N 3.12Å; L336-M339 PolarHBondContact O-N 3.49Å; M339-E342 PolarHBondContact O-N 3.21Å; M339-V343 WeakPolarHBondContact O-CG2 3.32Å; M339-V343 PolarHBondContact O-N 3.41Å
340	I	86.1	Confident	81.3	Confident	7 Å²	7	79.4 Å²	79.4	4%	0.036	40%	0.395	C	S	.	.	H	α-helix	trans	-62.7	-45.3	174.1	-74.8	168.4	0	0	0	110.4	L336 K337 H338 E342 V343 E344 F370 S373 L374	L336-I340 HydrophobicContact CD1-CD1 4.1Å; L336-I340 HydrophobicContact CD1-CG1 4.3Å; L336-I340 HydrophobicContact CG-CD1 3.89Å; L336-I340 WeakPolarHBondContact O-CB 3.3Å; L336-I340 VanDerWaalsContact O-CG1 3.28Å; L336-I340 WeakPolarHBondContact O-CG1 3.43Å; L336-I340 PolarHBondContact O-N 2.86Å; K337-I340 PolarHBondContact O-N 3.03Å; H338-I340 VanDerWaalsContact C-N 3.34Å; H338-I340 PolarHBondContact O-N 2.89Å; I340-E342 VanDerWaalsContact C-N 3.34Å; I340-E342 PolarHBondContact O-N 3.47Å; I340-V343 PolarHBondContact O-N 3.05Å; I340-E344 HydrophobicContact CG2-CG 4.47Å; I340-E344 WeakPolarHBondContact O-CB 3.43Å; I340-E344 WeakPolarHBondContact O-CG 3.49Å; I340-E344 PolarHBondContact O-N 2.9Å; I340-F370 HydrophobicContact CD1-CB 4.44Å; I340-S373 WeakPolarHBondContact CG2-OG 3.31Å; I340-L374 HydrophobicContact CD1-CB 3.99Å; I340-L374 HydrophobicContact CG1-CB 4.33Å; I340-L374 HydrophobicContact CG1-CD1 4.2Å
341	H	84.9	Confident	82.7	Confident	76 Å²	76	73.1 Å²	73.1	35%	0.352	36%	0.361	S	S	.	.	H	α-helix	trans	-68.3	-28.8	176.3	-70.9	-35.9	0	0	0	113.5	K337 H338 E344 H345	K337-H341 VanDerWaalsContact CE-NE2 3.3Å; K337-H341 WeakPolarHBondContact CE-NE2 3.4Å; K337-H341 PolarHBondContact O-CD2 2.9Å; K337-H341 PolarHBondContact O-N 3.34Å; H338-H341 PolarHBondContact O-N 2.91Å; H341-E344 IonicContact CE1-OE2 3.5Å; H341-E344 IonicContact CG-OE2 3.91Å; H341-E344 IonicContact ND1-OE2 3.98Å; H341-E344 PolarHBondContact ND1-OE2 2.87Å; H341-H345 VanDerWaalsContact O-CB 3.25Å; H341-H345 WeakPolarHBondContact O-CB 3.21Å; H341-H345 PolarHBondContact O-N 2.68Å
342	E	85.8	Confident	83.5	Confident	97 Å²	97	77.4 Å²	77.4	45%	0.453	37%	0.37	S	S	.	.	H	α-helix	trans	-66.2	-46.4	170.3	-73.2	177.7	132	0	0	111.2	H338 M339 I340 E344 H345 E346	H338-E342 IonicContact CE1-OE1 2.84Å; H338-E342 PolarHBondContact CE1-OE1 3.42Å; H338-E342 IonicContact CE1-OE2 2.75Å; H338-E342 IonicContact ND1-OE2 3.27Å; H338-E342 WeakPolarHBondContact O-CG 3.42Å; H338-E342 PolarHBondContact O-N 3.46Å; M339-E342 PolarHBondContact O-N 3.21Å; I340-E342 VanDerWaalsContact C-N 3.34Å; I340-E342 PolarHBondContact O-N 3.47Å; E342-E344 VanDerWaalsContact C-N 3.34Å; E342-E344 PolarHBondContact O-N 3.01Å; E342-H345 PolarHBondContact O-N 3.33Å; E342-E346 PolarHBondContact O-N 3.39Å
343	V	87.1	Confident	83.4	Confident	65 Å²	65	80.6 Å²	80.6	39%	0.394	37%	0.372	S	S	.	.	H	α-helix	trans	-65	-36.6	175.3	171.6	0	0	0	0	112	M339 I340 M347	M339-V343 WeakPolarHBondContact O-CG2 3.32Å; M339-V343 PolarHBondContact O-N 3.41Å; I340-V343 PolarHBondContact O-N 3.05Å; V343-M347 HydrophobicContact CG1-CE 4.45Å; V343-M347 WeakPolarHBondContact O-CB 3.33Å; V343-M347 PolarHBondContact O-N 3.47Å
344	E	84.3	Confident	83.1	Confident	28 Å²	28	81.1 Å²	81.1	13%	0.131	38%	0.377	C	S	.	.	H	α-helix	trans	-63	-47.8	171.9	-75	166.9	171.1	0	0	110.5	I340 H341 E342 M347 E348 S373 S377 R380	I340-E344 HydrophobicContact CG2-CG 4.47Å; I340-E344 WeakPolarHBondContact O-CB 3.43Å; I340-E344 WeakPolarHBondContact O-CG 3.49Å; I340-E344 PolarHBondContact O-N 2.9Å; H341-E344 IonicContact CE1-OE2 3.5Å; H341-E344 IonicContact CG-OE2 3.91Å; H341-E344 IonicContact ND1-OE2 3.98Å; H341-E344 PolarHBondContact ND1-OE2 2.87Å; E342-E344 VanDerWaalsContact C-N 3.34Å; E342-E344 PolarHBondContact O-N 3.01Å; E344-M347 WeakPolarHBondContact O-CB 3.28Å; E344-M347 PolarHBondContact O-N 2.96Å; E344-E348 WeakPolarHBondContact O-CG 3.47Å; E344-E348 PolarHBondContact O-N 2.98Å; E344-S373 PolarHBondContact OE1-OG 3.48Å; E344-S377 VanDerWaalsContact CG-OG 3.28Å; E344-S377 WeakPolarHBondContact CG-OG 3.14Å; E344-S377 PolarHBondContact OE1-OG 2.92Å; E344-R380 PolarHBondContact O-NH2 2.9Å
345	H	84.3	Confident	82.5	Confident	88 Å²	88	80.5 Å²	80.5	41%	0.407	39%	0.391	S	S	.	.	H	α-helix	trans	-64.8	-46.8	179.5	179.6	-92.9	0	0	0	113.8	H341 E342 M347 E348 E349	H341-H345 VanDerWaalsContact O-CB 3.25Å; H341-H345 WeakPolarHBondContact O-CB 3.21Å; H341-H345 PolarHBondContact O-N 2.68Å; E342-H345 PolarHBondContact O-N 3.33Å; H345-M347 PolarHBondContact O-N 3.29Å; H345-E348 CarbonylContact O-C 3.59Å; H345-E348 WeakPolarHBondContact O-CB 3.28Å; H345-E348 PolarHBondContact O-N 2.94Å; H345-E348 VanDerWaalsContact O-N 3.11Å; H345-E349 IonicContact CE1-OE1 2.71Å; H345-E349 PolarHBondContact CE1-OE1 3.17Å; H345-E349 IonicContact NE2-OE1 3.04Å; H345-E349 PolarHBondContact O-N 3.04Å
346	E	85.2	Confident	81.7	Confident	111 Å²	111	80.9 Å²	80.9	52%	0.519	39%	0.385	S	S	.	.	H	α-helix	trans	-56.7	-40.4	173.9	-75.8	-175.7	-176.1	0	0	110.8	E342 E349 Y350	E342-E346 PolarHBondContact O-N 3.39Å; E346-E349 CarbonylContact O-C 3.46Å; E346-E349 WeakPolarHBondContact O-CA 3.44Å; E346-E349 WeakPolarHBondContact O-CB 3.33Å; E346-E349 PolarHBondContact O-N 3.37Å; E346-E349 VanDerWaalsContact O-N 3.15Å; E346-Y350 WeakPolarHBondContact O-CD2 3.42Å; E346-Y350 PolarHBondContact O-N 2.98Å
347	M	83.5	Confident	80.5	Confident	4 Å²	4	83.9 Å²	83.9	2%	0.02	40%	0.397	C	S	.	.	H	α-helix	trans	-70.5	-31.3	178.1	-174.8	164.8	35.3	0	0	112.9	V343 E344 H345 Y350 E351 R380 L381 Y384	V343-M347 HydrophobicContact CG1-CE 4.45Å; V343-M347 WeakPolarHBondContact O-CB 3.33Å; V343-M347 PolarHBondContact O-N 3.47Å; E344-M347 WeakPolarHBondContact O-CB 3.28Å; E344-M347 PolarHBondContact O-N 2.96Å; H345-M347 PolarHBondContact O-N 3.29Å; M347-Y350 PolarHBondContact O-N 3.47Å; M347-E351 WeakPolarHBondContact O-CG 3.43Å; M347-E351 PolarHBondContact O-N 3.37Å; M347-R380 HydrophobicContact CE-CB 4.24Å; M347-R380 HydrophobicContact CE-CG 4.49Å; M347-R380 HydrophobicContact CG-CG 4.31Å; M347-R380 HydrophobicContact SD-CB 3.55Å; M347-R380 VanDerWaalsContact SD-CB 3.55Å; M347-R380 HydrophobicContact SD-CG 3.51Å; M347-R380 VanDerWaalsContact SD-CG 3.51Å; M347-R380 PolarHBondContact SD-NE 2.95Å; M347-L381 HydrophobicContact SD-CB 4.11Å; M347-L381 PolarHBondContact SD-N 2.97Å; M347-Y384 HydrophobicContact CG-CD2 3.99Å; M347-Y384 HydrophobicContact CG-CE2 3.96Å; M347-Y384 HydrophobicContact SD-CD2 4.39Å; M347-Y384 HydrophobicContact SD-CE2 4.44Å
348	E	85.4	Confident	79.5	Confident	53 Å²	53	82.9 Å²	82.9	25%	0.248	40%	0.398	C	S	.	.	H	α-helix	trans	-72	-26.6	168.2	-67	-177.4	174.9	0	0	112.7	E344 H345 R352 V358	E344-E348 WeakPolarHBondContact O-CG 3.47Å; E344-E348 PolarHBondContact O-N 2.98Å; H345-E348 CarbonylContact O-C 3.59Å; H345-E348 WeakPolarHBondContact O-CB 3.28Å; H345-E348 PolarHBondContact O-N 2.94Å; H345-E348 VanDerWaalsContact O-N 3.11Å; E348-R352 WeakPolarHBondContact O-CB 3.23Å; E348-R352 VanDerWaalsContact O-CG 3.3Å; E348-R352 WeakPolarHBondContact O-CG 3.49Å; E348-R352 PolarHBondContact O-N 3.3Å; E348-R352 VanDerWaalsContact O-N 3.09Å; E348-R352 PolarHBondContact O-NE 3.14Å; E348-V358 HydrophobicContact CB-CG1 4.24Å; E348-V358 HydrophobicContact CB-CG2 4.42Å; E348-V358 HydrophobicContact CG-CG1 3.67Å
349	E	82.7	Confident	78.4	Confident	74 Å²	74	84.1 Å²	84.1	35%	0.346	40%	0.402	S	S	.	.	H	α-helix	trans	-68.9	-47.7	166.5	-70.5	-170.2	155.6	0	0	110.8	H345 E346 E351 R352 W353	H345-E349 IonicContact CE1-OE1 2.71Å; H345-E349 PolarHBondContact CE1-OE1 3.17Å; H345-E349 IonicContact NE2-OE1 3.04Å; H345-E349 PolarHBondContact O-N 3.04Å; E346-E349 CarbonylContact O-C 3.46Å; E346-E349 WeakPolarHBondContact O-CA 3.44Å; E346-E349 WeakPolarHBondContact O-CB 3.33Å; E346-E349 PolarHBondContact O-N 3.37Å; E346-E349 VanDerWaalsContact O-N 3.15Å; E349-E351 VanDerWaalsContact C-N 3.28Å; E349-E351 PolarHBondContact O-N 3.2Å; E349-R352 CarbonylContact O-C 3.56Å; E349-R352 WeakPolarHBondContact O-CB 3.25Å; E349-R352 PolarHBondContact O-N 2.82Å; E349-R352 VanDerWaalsContact O-N 3.1Å; E349-W353 WeakPolarHBondContact O-CB 3.39Å; E349-W353 PolarHBondContact O-N 3.49Å
350	Y	83.1	Confident	77.1	Confident	147 Å²	147	81.4 Å²	81.4	58%	0.576	40%	0.401	S	S	*	.	H	α-helix	trans	-58.8	-36.8	174.1	-76.9	-69.2	0	0	0	112.9	E346 M347 T354	E346-Y350 WeakPolarHBondContact O-CD2 3.42Å; E346-Y350 PolarHBondContact O-N 2.98Å; M347-Y350 PolarHBondContact O-N 3.47Å; Y350-T354 PolarHBondContact O-N 3.39Å; Y350-T354 PolarHBondContact O-OG1 2.98Å
351	E	85.3	Confident	75.7	Confident	0 Å²	0	86.5 Å²	86.5	0%	0	43%	0.427	C	S	.	.	H	α-helix	trans	-60.8	-51.2	171	-76.6	168.9	159.4	0	0	111.3	M347 E349 W353 T354 G355 R356 V358 R380 Y384	M347-E351 WeakPolarHBondContact O-CG 3.43Å; M347-E351 PolarHBondContact O-N 3.37Å; E349-E351 VanDerWaalsContact C-N 3.28Å; E349-E351 PolarHBondContact O-N 3.2Å; E351-W353 PolarHBondContact O-N 2.98Å; E351-T354 CarbonylContact O-C 3.6Å; E351-T354 PolarHBondContact O-N 2.87Å; E351-G355 PolarHBondContact O-N 2.83Å; E351-R356 HydrophobicContact CB-CB 4.38Å; E351-R356 HydrophobicContact CG-CB 4.42Å; E351-R356 PolarHBondContact O-N 3.42Å; E351-V358 HydrophobicContact CB-CG2 3.95Å; E351-V358 WeakPolarHBondContact OE2-CA 3.39Å; E351-R380 WeakPolarHBondContact OE1-CD 3.18Å; E351-R380 IonicContact OE1-CZ 3.91Å; E351-R380 IonicContact OE1-NE 3.48Å; E351-R380 IonicContact OE1-NH1 2.67Å; E351-R380 PolarHBondContact OE1-NH1 3.4Å; E351-R380 IonicContact OE2-CZ 2.82Å; E351-R380 IonicContact OE2-NH1 3.19Å; E351-R380 PolarHBondContact OE2-NH1 2.94Å; E351-R380 IonicContact OE2-NH2 3.59Å; E351-Y384 HydrophobicContact CG-CD2 4.48Å; E351-Y384 HydrophobicContact CG-CE2 3.57Å; E351-Y384 WeakPolarHBondContact OE1-CE2 3.46Å; E351-Y384 VanDerWaalsContact OE1-CZ 3.24Å; E351-Y384 PolarHBondContact OE1-OH 2.78Å
352	R	82.8	Confident	74.3	Confident	133 Å²	133	91.4 Å²	91.4	50%	0.502	45%	0.451	S	S	.	.	H	α-helix	trans	-58.1	-47.8	175.7	-76.2	174.7	-82.4	165.9	-11.9	112.7	E348 E349 T354 G355 V358	E348-R352 WeakPolarHBondContact O-CB 3.23Å; E348-R352 VanDerWaalsContact O-CG 3.3Å; E348-R352 WeakPolarHBondContact O-CG 3.49Å; E348-R352 PolarHBondContact O-N 3.3Å; E348-R352 VanDerWaalsContact O-N 3.09Å; E348-R352 PolarHBondContact O-NE 3.14Å; E349-R352 CarbonylContact O-C 3.56Å; E349-R352 WeakPolarHBondContact O-CB 3.25Å; E349-R352 PolarHBondContact O-N 2.82Å; E349-R352 VanDerWaalsContact O-N 3.1Å; R352-T354 VanDerWaalsContact C-N 3.27Å; R352-T354 PolarHBondContact O-N 2.76Å; R352-G355 PolarHBondContact O-N 2.7Å; R352-G355 VanDerWaalsContact O-N 3.15Å; R352-V358 HydrophobicContact CG-CG2 4.35Å
353	W	70.8	Confident	72.9	Confident	215 Å²	215	90.3 Å²	90.3	81%	0.814	45%	0.454	S	S	*	.	H	α-helix	trans	-65	-26.5	178.7	-72.3	117.1	0	0	0	113.3	E349 E351	E349-W353 WeakPolarHBondContact O-CB 3.39Å; E349-W353 PolarHBondContact O-N 3.49Å; E351-W353 PolarHBondContact O-N 2.98Å
354	T	73.3	Confident	71.3	Confident	72 Å²	72	90.1 Å²	90.1	44%	0.442	46%	0.455	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.1	11.4	173.8	-14.4	0	0	0	0	114.2	Y350 E351 R352 R356	Y350-T354 PolarHBondContact O-N 3.39Å; Y350-T354 PolarHBondContact O-OG1 2.98Å; E351-T354 CarbonylContact O-C 3.6Å; E351-T354 PolarHBondContact O-N 2.87Å; R352-T354 VanDerWaalsContact C-N 3.27Å; R352-T354 PolarHBondContact O-N 2.76Å; T354-R356 VanDerWaalsContact C-N 3.3Å; T354-R356 PolarHBondContact O-N 3.22Å; T354-R356 PolarHBondContact OG1-NH2 3.28Å
355	G	69.7	Low	70.1	Confident	73 Å²	73	98 Å²	98	75%	0.753	49%	0.492	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.9	27.4	178.6	0	0	0	0	0	115.3	E351 R352	E351-G355 PolarHBondContact O-N 2.83Å; R352-G355 PolarHBondContact O-N 2.7Å; R352-G355 VanDerWaalsContact O-N 3.15Å
356	R	66.8	Low	69.2	Low	79 Å²	79	95.4 Å²	95.4	30%	0.298	49%	0.489	S	S	.	.			trans	-97.4	151.7	-178.9	-73.6	-174.3	-90.4	-119.2	2.7	112.2	E351 T354 V358	E351-R356 HydrophobicContact CB-CB 4.38Å; E351-R356 HydrophobicContact CG-CB 4.42Å; E351-R356 PolarHBondContact O-N 3.42Å; T354-R356 VanDerWaalsContact C-N 3.3Å; T354-R356 PolarHBondContact O-N 3.22Å; T354-R356 PolarHBondContact OG1-NH2 3.28Å; R356-V358 PolarHBondContact O-N 2.83Å
357	E	57.6	Low	68.2	Low	136 Å²	136	96.2 Å²	96.2	64%	0.636	50%	0.496	S	S	*	.			trans	-63.3	125.8	177	-176.8	-170.9	-136.2	0	0	111.3	K359	E357-K359 PolarHBondContact O-N 2.79Å; E357-K359 VanDerWaalsContact O-N 3.08Å; E357-K359 WeakPolarHBondContact OE2-CE 3.29Å; E357-K359 IonicContact OE2-NZ 2.69Å; E357-K359 PolarHBondContact OE2-NZ 3.46Å
358	V	62.2	Low	67.6	Low	62 Å²	62	101.6 Å²	101.6	38%	0.376	53%	0.529	S	S	.	.			trans	-75.9	94.8	177.1	170.4	0	0	0	0	110.3	E348 E351 R352 R356 G360	E348-V358 HydrophobicContact CB-CG1 4.24Å; E348-V358 HydrophobicContact CB-CG2 4.42Å; E348-V358 HydrophobicContact CG-CG1 3.67Å; E351-V358 HydrophobicContact CB-CG2 3.95Å; E351-V358 WeakPolarHBondContact OE2-CA 3.39Å; R352-V358 HydrophobicContact CG-CG2 4.35Å; R356-V358 PolarHBondContact O-N 2.83Å; V358-G360 VanDerWaalsContact C-N 3.29Å; V358-G360 PolarHBondContact O-N 2.77Å; V358-G360 VanDerWaalsContact O-N 3.11Å
359	K	61.6	Low	67.1	Low	140 Å²	140	99.4 Å²	99.4	61%	0.609	52%	0.521	S	S	*	.			trans	-84.8	69	173.1	-88.3	-175.3	162.7	109.3	0	111.9	E357 L361 R380	E357-K359 PolarHBondContact O-N 2.79Å; E357-K359 VanDerWaalsContact O-N 3.08Å; E357-K359 WeakPolarHBondContact OE2-CE 3.29Å; E357-K359 IonicContact OE2-NZ 2.69Å; E357-K359 PolarHBondContact OE2-NZ 3.46Å; K359-L361 PolarHBondContact O-N 2.9Å; K359-R380 PolarHBondContact O-NH1 3.24Å
360	G	57.2	Low	66.8	Low	49 Å²	49	97.7 Å²	97.7	51%	0.505	51%	0.513	S	S	.	.			trans	-59.3	113.5	170.1	0	0	0	0	0	111.1	V358	V358-G360 VanDerWaalsContact C-N 3.29Å; V358-G360 PolarHBondContact O-N 2.77Å; V358-G360 VanDerWaalsContact O-N 3.11Å
361	L	56.7	Low	66.8	Low	114 Å²	114	94.8 Å²	94.8	60%	0.597	51%	0.51	S	S	*	.			trans	-83.5	124.2	-177.9	-173.1	63.1	0	0	0	110.2	K359 S363 S376	K359-L361 PolarHBondContact O-N 2.9Å; L361-S363 PolarHBondContact O-N 3.19Å; L361-S376 WeakPolarHBondContact CD2-OG 3.44Å
362	Q	55.3	Low	66.6	Low	180 Å²	180	100 Å²	100	84%	0.841	54%	0.538	S	S	*	.			trans	-51.2	120.1	-179.8	-71.8	-89.6	-23.4	0	0	111.4	S364	Q362-S364 PolarHBondContact O-N 3.44Å
363	S	55.9	Low	66.7	Low	74 Å²	74	94.6 Å²	94.6	52%	0.517	52%	0.52	S	S	.	.			trans	-64.6	103.1	-173.3	62.9	0	0	0	0	112.4	L361 Q365	L361-S363 PolarHBondContact O-N 3.19Å; S363-Q365 PolarHBondContact O-N 3.37Å
364	S	54.5	Low	67.4	Low	60 Å²	60	88.2 Å²	88.2	42%	0.42	50%	0.502	S	S	.	.			trans	-70.8	110.9	179.7	56.6	0	0	0	0	111.1	Q362 G366 G369	Q362-S364 PolarHBondContact O-N 3.44Å; S364-G366 PolarHBondContact O-N 3Å; S364-G369 WeakPolarHBondContact OG-CA 3.25Å
365	Q	57.5	Low	68.1	Low	195 Å²	195	88.8 Å²	88.8	91%	0.911	51%	0.505	S	S	*	.			trans	-78.2	90.3	-172.6	-65.4	-178.6	-4.6	0	0	111.7	S363	S363-Q365 PolarHBondContact O-N 3.37Å
366	G	67.1	Low	68.8	Low	33 Å²	33	87.2 Å²	87.2	34%	0.34	48%	0.482	S	S	.	.	S	Bend	trans	177.5	164	173.5	0	0	0	0	0	112.5	S364 T368 G369 F370	S364-G366 PolarHBondContact O-N 3Å; G366-T368 VanDerWaalsContact C-N 3.28Å; G366-T368 PolarHBondContact O-N 3.43Å; G366-G369 WeakPolarHBondContact O-CA 3.22Å; G366-G369 PolarHBondContact O-N 3.36Å; G366-F370 WeakPolarHBondContact O-CD2 3.46Å; G366-F370 PolarHBondContact O-N 2.89Å
367	L	62.5	Low	69.7	Low	128 Å²	128	83.9 Å²	83.9	67%	0.67	47%	0.471	S	S	*	.	H	α-helix	trans	-58	-41.8	-177.1	-151.3	80.8	0	0	0	112.2	L333 G369 F370	L333-L367 HydrophobicContact CD1-CD1 3.83Å; L333-L367 HydrophobicContact CD2-CD1 3.69Å; L333-L367 HydrophobicContact CG-CD1 4.42Å; L367-G369 VanDerWaalsContact C-N 3.27Å; L367-G369 PolarHBondContact O-N 2.71Å; L367-F370 PolarHBondContact O-N 2.88Å
368	T	72.1	Confident	71.2	Confident	116 Å²	116	82.1 Å²	82.1	71%	0.712	47%	0.466	S	S	*	.	H	α-helix	trans	-69.4	-21.6	174.2	-27.3	0	0	0	0	113.3	G366 T371 L372	G366-T368 VanDerWaalsContact C-N 3.28Å; G366-T368 PolarHBondContact O-N 3.43Å; T368-T371 PolarHBondContact O-OG1 3.27Å; T368-T371 VanDerWaalsContact O-OG1 3.09Å; T368-L372 WeakPolarHBondContact O-CB 3.4Å; T368-L372 PolarHBondContact O-N 2.94Å
369	G	75	Confident	72.3	Confident	8 Å²	8	82.5 Å²	82.5	8%	0.082	47%	0.47	C	S	.	.	H	α-helix	trans	-72.9	-35.4	177.2	0	0	0	0	0	112.5	S364 G366 L367 L372 S373	S364-G369 WeakPolarHBondContact OG-CA 3.25Å; G366-G369 WeakPolarHBondContact O-CA 3.22Å; G366-G369 PolarHBondContact O-N 3.36Å; L367-G369 VanDerWaalsContact C-N 3.27Å; L367-G369 PolarHBondContact O-N 2.71Å; G369-L372 PolarHBondContact O-N 2.9Å; G369-S373 WeakPolarHBondContact O-CB 3.29Å; G369-S373 PolarHBondContact O-N 3Å
370	F	76.7	Confident	73.5	Confident	38 Å²	38	76.7 Å²	76.7	17%	0.167	44%	0.444	C	S	.	.	H	α-helix	trans	-67.5	-41	176.7	-64.9	-69	0	0	0	113	L333 K337 I340 G366 L367 L372 S373 L374	L333-F370 HydrophobicContact CD1-CD2 3.68Å; L333-F370 HydrophobicContact CD1-CE2 3.99Å; L333-F370 HydrophobicContact CD1-CG 4.23Å; L333-F370 HydrophobicContact CD2-CD2 4.49Å; L333-F370 HydrophobicContact CD2-CE2 4.06Å; L333-F370 HydrophobicContact CG-CD2 4.3Å; L333-F370 HydrophobicContact CG-CE2 4.1Å; K337-F370 HydrophobicContact CB-CD1 4.3Å; K337-F370 HydrophobicContact CB-CE1 3.79Å; K337-F370 HydrophobicContact CB-CZ 4.46Å; K337-F370 HydrophobicContact CD-CE1 3.72Å; K337-F370 HydrophobicContact CD-CZ 4.01Å; K337-F370 HydrophobicContact CG-CD1 4.49Å; K337-F370 HydrophobicContact CG-CE1 3.7Å; K337-F370 HydrophobicContact CG-CZ 4.43Å; I340-F370 HydrophobicContact CD1-CB 4.44Å; G366-F370 WeakPolarHBondContact O-CD2 3.46Å; G366-F370 PolarHBondContact O-N 2.89Å; L367-F370 PolarHBondContact O-N 2.88Å; F370-L372 VanDerWaalsContact C-N 3.32Å; F370-S373 PolarHBondContact O-N 3.41Å; F370-L374 WeakPolarHBondContact O-CB 3.47Å; F370-L374 PolarHBondContact O-N 3.45Å
371	T	82.4	Confident	75.1	Confident	86 Å²	86	78 Å²	78	53%	0.528	44%	0.439	S	S	.	.	H	α-helix	trans	-67.5	-35.4	174.7	49.1	0	0	0	0	111.5	T368 V375	T368-T371 PolarHBondContact O-OG1 3.27Å; T368-T371 VanDerWaalsContact O-OG1 3.09Å; T371-V375 WeakPolarHBondContact O-CB 3.45Å; T371-V375 VanDerWaalsContact O-CG2 3.29Å; T371-V375 WeakPolarHBondContact O-CG2 3.48Å; T371-V375 PolarHBondContact O-N 3.48Å
372	L	81.8	Confident	76.7	Confident	110 Å²	110	76.9 Å²	76.9	58%	0.576	44%	0.437	S	S	*	.	H	α-helix	trans	-69.2	-42	174.5	-175.5	61.1	0	0	0	112.9	T368 G369 F370 V375 S376	T368-L372 WeakPolarHBondContact O-CB 3.4Å; T368-L372 PolarHBondContact O-N 2.94Å; G369-L372 PolarHBondContact O-N 2.9Å; F370-L372 VanDerWaalsContact C-N 3.32Å; L372-V375 PolarHBondContact O-N 3.03Å; L372-S376 WeakPolarHBondContact O-CB 3.35Å; L372-S376 PolarHBondContact O-N 3.3Å
373	S	83.9	Confident	78.3	Confident	18 Å²	18	75.5 Å²	75.5	13%	0.126	42%	0.424	C	S	.	.	H	α-helix	trans	-64.5	-45.6	174.2	143.1	0	0	0	0	110.9	I340 E344 G369 F370 V375 S376 S377	I340-S373 WeakPolarHBondContact CG2-OG 3.31Å; E344-S373 PolarHBondContact OE1-OG 3.48Å; G369-S373 WeakPolarHBondContact O-CB 3.29Å; G369-S373 PolarHBondContact O-N 3Å; F370-S373 PolarHBondContact O-N 3.41Å; S373-V375 PolarHBondContact O-N 2.83Å; S373-S376 WeakPolarHBondContact O-CB 3.46Å; S373-S376 PolarHBondContact O-N 3.42Å; S373-S377 VanDerWaalsContact O-CB 3.28Å; S373-S377 WeakPolarHBondContact O-CB 3.28Å; S373-S377 PolarHBondContact O-N 2.95Å; S373-S377 PolarHBondContact O-OG 3.44Å
374	L	85.1	Confident	79.9	Confident	82 Å²	82	74.2 Å²	74.2	43%	0.429	41%	0.408	S	S	.	.	H	α-helix	trans	-58.3	-45.3	175.8	178.9	61.1	0	0	0	112.3	I340 F370 L378	I340-L374 HydrophobicContact CD1-CB 3.99Å; I340-L374 HydrophobicContact CG1-CB 4.33Å; I340-L374 HydrophobicContact CG1-CD1 4.2Å; F370-L374 WeakPolarHBondContact O-CB 3.47Å; F370-L374 PolarHBondContact O-N 3.45Å; L374-L378 WeakPolarHBondContact O-CB 3.17Å; L374-L378 PolarHBondContact O-N 3.48Å
375	V	87.9	Confident	81.7	Confident	83 Å²	83	76.6 Å²	76.6	50%	0.503	42%	0.416	S	S	.	.	H	α-helix	trans	-68.6	-39.3	177	170.6	0	0	0	0	111.7	T371 L372 S373 L378 C379	T371-V375 WeakPolarHBondContact O-CB 3.45Å; T371-V375 VanDerWaalsContact O-CG2 3.29Å; T371-V375 WeakPolarHBondContact O-CG2 3.48Å; T371-V375 PolarHBondContact O-N 3.48Å; L372-V375 PolarHBondContact O-N 3.03Å; S373-V375 PolarHBondContact O-N 2.83Å; V375-L378 PolarHBondContact O-N 2.88Å; V375-C379 VanDerWaalsContact O-CB 3.31Å; V375-C379 WeakPolarHBondContact O-CB 3.33Å; V375-C379 PolarHBondContact O-N 3.22Å; V375-C379 PolarHBondContact O-SG 3.5Å
376	S	84.5	Confident	83.3	Confident	41 Å²	41	74 Å²	74	29%	0.287	40%	0.401	S	S	.	.	H	α-helix	trans	-61.1	-46.7	174.9	-176.3	0	0	0	0	111.7	L361 L372 S373 C379 R380	L361-S376 WeakPolarHBondContact CD2-OG 3.44Å; L372-S376 WeakPolarHBondContact O-CB 3.35Å; L372-S376 PolarHBondContact O-N 3.3Å; S373-S376 WeakPolarHBondContact O-CB 3.46Å; S373-S376 PolarHBondContact O-N 3.42Å; S376-C379 CarbonylContact O-C 3.55Å; S376-C379 WeakPolarHBondContact O-CB 3.38Å; S376-C379 PolarHBondContact O-N 3.17Å; S376-R380 PolarHBondContact O-N 3.04Å
377	S	86.4	Confident	84.4	Confident	9 Å²	9	75.9 Å²	75.9	6%	0.063	40%	0.401	C	S	.	.	H	α-helix	trans	-67.2	-39.2	178.7	-73	0	0	0	0	112.1	E344 S373 R380 L381	E344-S377 VanDerWaalsContact CG-OG 3.28Å; E344-S377 WeakPolarHBondContact CG-OG 3.14Å; E344-S377 PolarHBondContact OE1-OG 2.92Å; S373-S377 VanDerWaalsContact O-CB 3.28Å; S373-S377 WeakPolarHBondContact O-CB 3.28Å; S373-S377 PolarHBondContact O-N 2.95Å; S373-S377 PolarHBondContact O-OG 3.44Å; S377-R380 PolarHBondContact O-N 3.47Å; S377-L381 WeakPolarHBondContact O-CB 3.25Å; S377-L381 PolarHBondContact O-N 3.23Å
378	L	88.4	Confident	85.8	Confident	99 Å²	99	72.7 Å²	72.7	52%	0.518	39%	0.39	S	S	.	.	H	α-helix	trans	-61.5	-42.6	169.2	-172.9	68.1	0	0	0	111.7	L374 V375 R380 L381 V382	L374-L378 WeakPolarHBondContact O-CB 3.17Å; L374-L378 PolarHBondContact O-N 3.48Å; V375-L378 PolarHBondContact O-N 2.88Å; L378-R380 VanDerWaalsContact C-N 3.33Å; L378-R380 PolarHBondContact O-N 2.92Å; L378-L381 PolarHBondContact O-N 2.9Å; L378-V382 WeakPolarHBondContact O-CB 3.33Å; L378-V382 WeakPolarHBondContact O-CG2 3.21Å; L378-V382 PolarHBondContact O-N 3.13Å
379	C	85.9	Confident	86.8	Confident	69 Å²	69	71.1 Å²	71.1	47%	0.466	37%	0.374	S	S	.	.	H	α-helix	trans	-70.4	-23.3	175.7	-74.3	0	0	0	0	113.7	V375 S376 R383	V375-C379 VanDerWaalsContact O-CB 3.31Å; V375-C379 WeakPolarHBondContact O-CB 3.33Å; V375-C379 PolarHBondContact O-N 3.22Å; V375-C379 PolarHBondContact O-SG 3.5Å; S376-C379 CarbonylContact O-C 3.55Å; S376-C379 WeakPolarHBondContact O-CB 3.38Å; S376-C379 PolarHBondContact O-N 3.17Å; C379-R383 WeakPolarHBondContact O-CG 3.23Å; C379-R383 PolarHBondContact O-NE 2.96Å
380	R	87.7	Confident	87.7	Confident	18 Å²	18	73.8 Å²	73.8	7%	0.068	39%	0.386	C	S	.	.	H	α-helix	trans	-75.5	-47.2	169.4	-170.7	169.4	79.3	153.6	-4.8	109.9	E344 M347 E351 K359 S376 S377 L378 V382 R383 Y384	E344-R380 PolarHBondContact O-NH2 2.9Å; M347-R380 HydrophobicContact CE-CB 4.24Å; M347-R380 HydrophobicContact CE-CG 4.49Å; M347-R380 HydrophobicContact CG-CG 4.31Å; M347-R380 HydrophobicContact SD-CB 3.55Å; M347-R380 VanDerWaalsContact SD-CB 3.55Å; M347-R380 HydrophobicContact SD-CG 3.51Å; M347-R380 VanDerWaalsContact SD-CG 3.51Å; M347-R380 PolarHBondContact SD-NE 2.95Å; E351-R380 WeakPolarHBondContact OE1-CD 3.18Å; E351-R380 IonicContact OE1-CZ 3.91Å; E351-R380 IonicContact OE1-NE 3.48Å; E351-R380 IonicContact OE1-NH1 2.67Å; E351-R380 PolarHBondContact OE1-NH1 3.4Å; E351-R380 IonicContact OE2-CZ 2.82Å; E351-R380 IonicContact OE2-NH1 3.19Å; E351-R380 PolarHBondContact OE2-NH1 2.94Å; E351-R380 IonicContact OE2-NH2 3.59Å; K359-R380 PolarHBondContact O-NH1 3.24Å; S376-R380 PolarHBondContact O-N 3.04Å; S377-R380 PolarHBondContact O-N 3.47Å; L378-R380 VanDerWaalsContact C-N 3.33Å; L378-R380 PolarHBondContact O-N 2.92Å; R380-V382 PolarHBondContact O-N 2.91Å; R380-R383 PolarHBondContact O-N 2.65Å; R380-Y384 HydrophobicContact CG-CD2 4.13Å; R380-Y384 HydrophobicContact CG-CE1 4.41Å; R380-Y384 HydrophobicContact CG-CE2 3.44Å; R380-Y384 VanDerWaalsContact CG-CE2 3.44Å; R380-Y384 PolarHBondContact O-N 2.69Å
381	L	89.1	Confident	88.5	Confident	77 Å²	77	76.6 Å²	76.6	40%	0.403	40%	0.4	S	S	.	.	H	α-helix	trans	-58.8	-47.7	176.1	-179.2	62.3	0	0	0	112.9	M347 S377 L378 R383 Y384 L385	M347-L381 HydrophobicContact SD-CB 4.11Å; M347-L381 PolarHBondContact SD-N 2.97Å; S377-L381 WeakPolarHBondContact O-CB 3.25Å; S377-L381 PolarHBondContact O-N 3.23Å; L378-L381 PolarHBondContact O-N 2.9Å; L381-R383 VanDerWaalsContact C-N 3.29Å; L381-R383 PolarHBondContact O-N 3.37Å; L381-Y384 PolarHBondContact O-N 3.41Å; L381-Y384 VanDerWaalsContact O-N 3.14Å; L381-L385 WeakPolarHBondContact O-CB 3.4Å; L381-L385 PolarHBondContact O-N 2.93Å
382	V	91	Very high	89.1	Confident	91 Å²	91	77.3 Å²	77.3	55%	0.552	40%	0.4	S	S	*	.	H	α-helix	trans	-63.6	-34.4	178.9	169.9	0	0	0	0	112	L378 R380 K386	L378-V382 WeakPolarHBondContact O-CB 3.33Å; L378-V382 WeakPolarHBondContact O-CG2 3.21Å; L378-V382 PolarHBondContact O-N 3.13Å; R380-V382 PolarHBondContact O-N 2.91Å; V382-K386 WeakPolarHBondContact O-CB 3.16Å; V382-K386 PolarHBondContact O-N 3.36Å; V382-K386 VanDerWaalsContact O-N 3.08Å
383	R	88.1	Confident	89.8	Confident	151 Å²	151	79.9 Å²	79.9	57%	0.57	40%	0.402	S	S	*	.	H	α-helix	trans	-66.5	-43	172.5	-77.4	-179.9	-67.4	152.2	0.1	111.6	C379 R380 L381 K386 E387	C379-R383 WeakPolarHBondContact O-CG 3.23Å; C379-R383 PolarHBondContact O-NE 2.96Å; R380-R383 PolarHBondContact O-N 2.65Å; L381-R383 VanDerWaalsContact C-N 3.29Å; L381-R383 PolarHBondContact O-N 3.37Å; R383-K386 PolarHBondContact O-N 2.9Å; R383-E387 WeakPolarHBondContact O-CB 3.23Å; R383-E387 PolarHBondContact O-N 3.5Å
384	Y	89.3	Confident	90.4	Very high	46 Å²	46	83.8 Å²	83.8	18%	0.18	42%	0.416	C	S	.	.	H	α-helix	trans	-71.6	-33	178.6	-63	-17.1	0	0	0	113.1	M347 E351 R380 L381 E387 S388	M347-Y384 HydrophobicContact CG-CD2 3.99Å; M347-Y384 HydrophobicContact CG-CE2 3.96Å; M347-Y384 HydrophobicContact SD-CD2 4.39Å; M347-Y384 HydrophobicContact SD-CE2 4.44Å; E351-Y384 HydrophobicContact CG-CD2 4.48Å; E351-Y384 HydrophobicContact CG-CE2 3.57Å; E351-Y384 WeakPolarHBondContact OE1-CE2 3.46Å; E351-Y384 VanDerWaalsContact OE1-CZ 3.24Å; E351-Y384 PolarHBondContact OE1-OH 2.78Å; R380-Y384 HydrophobicContact CG-CD2 4.13Å; R380-Y384 HydrophobicContact CG-CE1 4.41Å; R380-Y384 HydrophobicContact CG-CE2 3.44Å; R380-Y384 VanDerWaalsContact CG-CE2 3.44Å; R380-Y384 PolarHBondContact O-N 2.69Å; L381-Y384 PolarHBondContact O-N 3.41Å; L381-Y384 VanDerWaalsContact O-N 3.14Å; Y384-E387 PolarHBondContact O-N 2.88Å; Y384-S388 WeakPolarHBondContact O-CB 3.23Å; Y384-S388 PolarHBondContact O-N 2.64Å; Y384-S388 PolarHBondContact O-OG 3.44Å
385	L	92.6	Very high	91	Very high	111 Å²	111	83.9 Å²	83.9	58%	0.581	42%	0.415	S	S	*	.	H	α-helix	trans	-61.7	-49.8	170.6	-171.2	150.6	0	0	0	110.2	L381 E387 S388 E389	L381-L385 WeakPolarHBondContact O-CB 3.4Å; L381-L385 PolarHBondContact O-N 2.93Å; L385-E387 PolarHBondContact O-N 2.58Å; L385-S388 PolarHBondContact O-N 3.42Å; L385-S388 PolarHBondContact O-OG 3.11Å; L385-E389 PolarHBondContact O-N 2.99Å
386	K	92.8	Very high	91.5	Very high	140 Å²	140	83.8 Å²	83.8	61%	0.609	41%	0.414	S	S	*	.	H	α-helix	trans	-60.4	-43.9	176.4	-173.9	-179.7	178	-175.3	0	112.7	V382 R383 S388 E389 I390	V382-K386 WeakPolarHBondContact O-CB 3.16Å; V382-K386 PolarHBondContact O-N 3.36Å; V382-K386 VanDerWaalsContact O-N 3.08Å; R383-K386 PolarHBondContact O-N 2.9Å; K386-S388 VanDerWaalsContact C-N 3.35Å; K386-E389 PolarHBondContact O-N 2.79Å; K386-I390 HydrophobicContact CG-CD1 4.26Å; K386-I390 WeakPolarHBondContact O-CG1 3.47Å; K386-I390 PolarHBondContact O-N 3.37Å; K386-I390 VanDerWaalsContact O-N 3.08Å
387	E	89.4	Confident	92.1	Very high	73 Å²	73	87.3 Å²	87.3	34%	0.341	43%	0.426	S	S	.	.	H	α-helix	trans	-67.3	-36.2	177.8	-169.3	57.7	-144.8	0	0	111.8	R383 Y384 L385 E389 I390 Q391	R383-E387 WeakPolarHBondContact O-CB 3.23Å; R383-E387 PolarHBondContact O-N 3.5Å; Y384-E387 PolarHBondContact O-N 2.88Å; L385-E387 PolarHBondContact O-N 2.58Å; E387-E389 VanDerWaalsContact C-N 3.34Å; E387-I390 PolarHBondContact O-N 2.77Å; E387-Q391 WeakPolarHBondContact O-CB 3.46Å; E387-Q391 PolarHBondContact O-N 2.95Å
388	S	90.8	Very high	92.6	Very high	60 Å²	60	89.9 Å²	89.9	42%	0.42	44%	0.442	S	S	.	.	H	α-helix	trans	-66	-35.2	174.2	75.4	0	0	0	0	112.3	Y384 L385 K386 Q391 L392	Y384-S388 WeakPolarHBondContact O-CB 3.23Å; Y384-S388 PolarHBondContact O-N 2.64Å; Y384-S388 PolarHBondContact O-OG 3.44Å; L385-S388 PolarHBondContact O-N 3.42Å; L385-S388 PolarHBondContact O-OG 3.11Å; K386-S388 VanDerWaalsContact C-N 3.35Å; S388-Q391 PolarHBondContact O-N 2.72Å; S388-L392 WeakPolarHBondContact O-CB 3.28Å; S388-L392 PolarHBondContact O-N 3.01Å
389	E	93.8	Very high	93.1	Very high	84 Å²	84	92.6 Å²	92.6	39%	0.393	45%	0.445	S	S	.	.	H	α-helix	trans	-67.6	-41.4	174.3	-161.7	-159	143	0	0	111.3	L385 K386 E387 L392 R393	L385-E389 PolarHBondContact O-N 2.99Å; K386-E389 PolarHBondContact O-N 2.79Å; E387-E389 VanDerWaalsContact C-N 3.34Å; E389-L392 PolarHBondContact O-N 3.02Å; E389-R393 WeakPolarHBondContact O-CB 3.45Å; E389-R393 WeakPolarHBondContact O-CD 3.48Å; E389-R393 WeakPolarHBondContact O-CG 3.46Å; E389-R393 PolarHBondContact O-N 3.02Å; E389-R393 IonicContact OE1-CZ 3.33Å; E389-R393 IonicContact OE1-NE 3.61Å; E389-R393 PolarHBondContact OE1-NE 3.38Å; E389-R393 IonicContact OE1-NH2 3.78Å; E389-R393 PolarHBondContact OE1-NH2 3.25Å
390	I	93.8	Very high	93.7	Very high	63 Å²	63	95.4 Å²	95.4	32%	0.323	45%	0.451	S	S	.	.	H	α-helix	trans	-63.2	-43.8	174.3	-69.1	166.3	0	0	0	110.6	K386 E387 R393 K394	K386-I390 HydrophobicContact CG-CD1 4.26Å; K386-I390 WeakPolarHBondContact O-CG1 3.47Å; K386-I390 PolarHBondContact O-N 3.37Å; K386-I390 VanDerWaalsContact O-N 3.08Å; E387-I390 PolarHBondContact O-N 2.77Å; I390-R393 PolarHBondContact O-N 3.35Å; I390-K394 WeakPolarHBondContact O-CG 3.48Å; I390-K394 PolarHBondContact O-N 2.95Å; I390-K394 VanDerWaalsContact O-N 3.1Å
391	Q	94.1	Very high	94.1	Very high	98 Å²	98	99.3 Å²	99.3	46%	0.458	47%	0.47	S	S	.	.	H	α-helix	trans	-67.6	-40.8	178.6	-169.2	64.9	8.7	0	0	112.1	E387 S388 R393 K394 E395	E387-Q391 WeakPolarHBondContact O-CB 3.46Å; E387-Q391 PolarHBondContact O-N 2.95Å; S388-Q391 PolarHBondContact O-N 2.72Å; Q391-R393 VanDerWaalsContact C-N 3.35Å; Q391-R393 PolarHBondContact O-N 2.94Å; Q391-K394 PolarHBondContact O-N 3.15Å; Q391-E395 PolarHBondContact O-N 3.13Å
392	L	95.4	Very high	94.6	Very high	101 Å²	101	101 Å²	101	53%	0.529	48%	0.479	S	S	.	.	H	α-helix	trans	-62.3	-40.7	174.4	178.6	62.7	0	0	0	111.6	S388 E389 E395 V396	S388-L392 WeakPolarHBondContact O-CB 3.28Å; S388-L392 PolarHBondContact O-N 3.01Å; E389-L392 PolarHBondContact O-N 3.02Å; L392-E395 PolarHBondContact O-N 2.85Å; L392-V396 HydrophobicContact CD1-CG2 4.38Å; L392-V396 WeakPolarHBondContact O-CG2 3.4Å; L392-V396 PolarHBondContact O-N 3.14Å
393	R	96.6	Very high	94.9	Very high	164 Å²	164	103.4 Å²	103.4	62%	0.619	48%	0.484	S	S	*	.	H	α-helix	trans	-61.1	-45.5	174.7	-74	164.1	178.2	-101.7	7.2	111.6	E389 I390 Q391 E395 V396 E397	E389-R393 WeakPolarHBondContact O-CB 3.45Å; E389-R393 WeakPolarHBondContact O-CD 3.48Å; E389-R393 WeakPolarHBondContact O-CG 3.46Å; E389-R393 PolarHBondContact O-N 3.02Å; E389-R393 IonicContact OE1-CZ 3.33Å; E389-R393 IonicContact OE1-NE 3.61Å; E389-R393 PolarHBondContact OE1-NE 3.38Å; E389-R393 IonicContact OE1-NH2 3.78Å; E389-R393 PolarHBondContact OE1-NH2 3.25Å; I390-R393 PolarHBondContact O-N 3.35Å; Q391-R393 VanDerWaalsContact C-N 3.35Å; Q391-R393 PolarHBondContact O-N 2.94Å; R393-E395 VanDerWaalsContact C-N 3.33Å; R393-E395 PolarHBondContact O-N 3.44Å; R393-V396 PolarHBondContact O-N 3.26Å; R393-E397 PolarHBondContact O-N 3.4Å
394	K	96.5	Very high	95.4	Very high	99 Å²	99	102.3 Å²	102.3	43%	0.43	49%	0.485	S	S	.	.	H	α-helix	trans	-61.1	-40.5	174	-66.8	167.8	-172.2	165	0	112	I390 Q391 E397 T398	I390-K394 WeakPolarHBondContact O-CG 3.48Å; I390-K394 PolarHBondContact O-N 2.95Å; I390-K394 VanDerWaalsContact O-N 3.1Å; Q391-K394 PolarHBondContact O-N 3.15Å; K394-E397 PolarHBondContact O-N 2.84Å; K394-T398 PolarHBondContact O-N 2.88Å; K394-T398 PolarHBondContact O-OG1 3.17Å
395	E	96.8	Very high	95.8	Very high	85 Å²	85	103.4 Å²	103.4	40%	0.397	50%	0.497	S	S	.	.	H	α-helix	trans	-69.8	-36.7	179	-161.2	-168.9	162	0	0	112.2	Q391 L392 R393 T398 R399	Q391-E395 PolarHBondContact O-N 3.13Å; L392-E395 PolarHBondContact O-N 2.85Å; R393-E395 VanDerWaalsContact C-N 3.33Å; R393-E395 PolarHBondContact O-N 3.44Å; E395-T398 PolarHBondContact O-OG1 3.48Å; E395-R399 VanDerWaalsContact O-CB 3.26Å; E395-R399 WeakPolarHBondContact O-CB 3.48Å; E395-R399 WeakPolarHBondContact O-CD 3.39Å; E395-R399 WeakPolarHBondContact O-CG 3.49Å; E395-R399 PolarHBondContact O-N 3.24Å; E395-R399 IonicContact OE1-CZ 3.93Å; E395-R399 IonicContact OE1-NE 2.74Å; E395-R399 PolarHBondContact OE1-NE 2.74Å; E395-R399 IonicContact OE1-NH2 3.19Å; E395-R399 PolarHBondContact OE1-NH2 2.76Å
396	V	97.8	Very high	96.1	Very high	81 Å²	81	103.7 Å²	103.7	49%	0.491	50%	0.498	S	S	.	.	H	α-helix	trans	-64.5	-41.7	172	169.3	0	0	0	0	110.8	L392 R393 R399 Q400	L392-V396 HydrophobicContact CD1-CG2 4.38Å; L392-V396 WeakPolarHBondContact O-CG2 3.4Å; L392-V396 PolarHBondContact O-N 3.14Å; R393-V396 PolarHBondContact O-N 3.26Å; V396-R399 PolarHBondContact O-N 2.91Å; V396-Q400 WeakPolarHBondContact O-CB 3.33Å; V396-Q400 PolarHBondContact O-N 3.01Å
397	E	98	Very high	96.4	Very high	114 Å²	114	98.9 Å²	98.9	53%	0.533	49%	0.488	S	S	.	.	H	α-helix	trans	-62.6	-46.7	176.2	-174.5	178.2	-177.3	0	0	112.1	R393 K394 Q400 Q401	R393-E397 PolarHBondContact O-N 3.4Å; K394-E397 PolarHBondContact O-N 2.84Å; E397-Q400 PolarHBondContact O-N 2.88Å; E397-Q401 WeakPolarHBondContact O-CG 3.31Å; E397-Q401 PolarHBondContact O-N 3.4Å
398	T	97.6	Very high	96.8	Very high	64 Å²	64	99.4 Å²	99.4	39%	0.393	49%	0.494	S	S	.	.	H	α-helix	trans	-68.5	-38.3	176.8	57.2	0	0	0	0	112.3	K394 E395 Q400 Q401 L402	K394-T398 PolarHBondContact O-N 2.88Å; K394-T398 PolarHBondContact O-OG1 3.17Å; E395-T398 PolarHBondContact O-OG1 3.48Å; T398-Q400 VanDerWaalsContact C-N 3.3Å; T398-Q400 PolarHBondContact O-N 3.44Å; T398-Q401 PolarHBondContact O-N 3.32Å; T398-L402 WeakPolarHBondContact O-CD1 3.25Å; T398-L402 PolarHBondContact O-N 2.87Å
399	R	97.8	Very high	97.1	Very high	156 Å²	156	101.4 Å²	101.4	59%	0.589	50%	0.496	S	S	*	.	H	α-helix	trans	-58.4	-41.7	171.8	-75.1	167.9	179.4	-147.8	7.1	111.5	E395 V396 L402 E403	E395-R399 VanDerWaalsContact O-CB 3.26Å; E395-R399 WeakPolarHBondContact O-CB 3.48Å; E395-R399 WeakPolarHBondContact O-CD 3.39Å; E395-R399 WeakPolarHBondContact O-CG 3.49Å; E395-R399 PolarHBondContact O-N 3.24Å; E395-R399 IonicContact OE1-CZ 3.93Å; E395-R399 IonicContact OE1-NE 2.74Å; E395-R399 PolarHBondContact OE1-NE 2.74Å; E395-R399 IonicContact OE1-NH2 3.19Å; E395-R399 PolarHBondContact OE1-NH2 2.76Å; V396-R399 PolarHBondContact O-N 2.91Å; R399-L402 PolarHBondContact O-N 2.74Å; R399-E403 WeakPolarHBondContact O-CB 3.46Å; R399-E403 PolarHBondContact O-N 3.2Å
400	Q	98	Very high	97.4	Very high	128 Å²	128	104.4 Å²	104.4	60%	0.598	50%	0.504	S	S	*	.	H	α-helix	trans	-66	-38.8	176.2	-172.4	176.9	10.9	0	0	112.3	V396 E397 T398 E403 Q404	V396-Q400 WeakPolarHBondContact O-CB 3.33Å; V396-Q400 PolarHBondContact O-N 3.01Å; E397-Q400 PolarHBondContact O-N 2.88Å; T398-Q400 VanDerWaalsContact C-N 3.3Å; T398-Q400 PolarHBondContact O-N 3.44Å; Q400-E403 PolarHBondContact O-N 3.12Å; Q400-Q404 PolarHBondContact O-N 3.02Å
401	Q	98	Very high	97.6	Very high	99 Å²	99	108.3 Å²	108.3	46%	0.463	52%	0.521	S	S	.	.	H	α-helix	trans	-63.3	-43	173.1	-68.9	166.9	8.2	0	0	111.7	E397 T398 Q404 V405	E397-Q401 WeakPolarHBondContact O-CG 3.31Å; E397-Q401 PolarHBondContact O-N 3.4Å; T398-Q401 PolarHBondContact O-N 3.32Å; Q401-Q404 PolarHBondContact O-N 2.89Å; Q401-V405 WeakPolarHBondContact O-CG2 3.26Å; Q401-V405 PolarHBondContact O-N 2.88Å
402	L	98.3	Very high	97.8	Very high	113 Å²	113	108.4 Å²	108.4	59%	0.592	52%	0.524	S	S	*	.	H	α-helix	trans	-65.7	-38.9	174.2	-87.5	93	0	0	0	112.3	T398 R399 V405 L406	T398-L402 WeakPolarHBondContact O-CD1 3.25Å; T398-L402 PolarHBondContact O-N 2.87Å; R399-L402 PolarHBondContact O-N 2.74Å; L402-V405 PolarHBondContact O-N 3.47Å; L402-L406 VanDerWaalsContact O-CG 3.31Å; L402-L406 WeakPolarHBondContact O-CG 3.24Å; L402-L406 PolarHBondContact O-N 3.29Å
403	E	98.1	Very high	97.9	Very high	141 Å²	141	108.1 Å²	108.1	66%	0.659	52%	0.522	S	S	*	.	H	α-helix	trans	-62.3	-41.7	175.6	-175	172.6	-163.9	0	0	111.5	R399 Q400 L406 G407	R399-E403 WeakPolarHBondContact O-CB 3.46Å; R399-E403 PolarHBondContact O-N 3.2Å; Q400-E403 PolarHBondContact O-N 3.12Å; E403-L406 PolarHBondContact O-N 2.86Å; E403-G407 PolarHBondContact O-N 3.34Å
404	Q	98	Very high	98	Very high	128 Å²	128	103.8 Å²	103.8	60%	0.598	51%	0.511	S	S	*	.	H	α-helix	trans	-60.8	-48.8	172.6	-177	177.8	-15.3	0	0	111.7	Q400 Q401 L406 G407 D408	Q400-Q404 PolarHBondContact O-N 3.02Å; Q401-Q404 PolarHBondContact O-N 2.89Å; Q404-L406 VanDerWaalsContact C-N 3.26Å; Q404-L406 PolarHBondContact O-N 3.01Å; Q404-G407 CarbonylContact O-C 3.56Å; Q404-G407 WeakPolarHBondContact O-CA 3.4Å; Q404-G407 PolarHBondContact O-N 3.02Å; Q404-D408 PolarHBondContact O-N 3.36Å
405	V	98.4	Very high	98.1	Very high	70 Å²	70	101.9 Å²	101.9	42%	0.424	51%	0.514	S	S	.	.	H	α-helix	trans	-61.6	-33.7	178.4	170.5	0	0	0	0	112	Q401 L402 G407 D408 H409	Q401-V405 WeakPolarHBondContact O-CG2 3.26Å; Q401-V405 PolarHBondContact O-N 2.88Å; L402-V405 PolarHBondContact O-N 3.47Å; V405-G407 VanDerWaalsContact C-N 3.35Å; V405-D408 PolarHBondContact O-N 3.45Å; V405-H409 WeakPolarHBondContact O-CB 3.48Å; V405-H409 PolarHBondContact O-N 3.07Å
406	L	98.4	Very high	98.2	Very high	116 Å²	116	102.3 Å²	102.3	61%	0.607	52%	0.518	S	S	*	.	H	α-helix	trans	-69	-32.1	172.2	-71.3	171.4	0	0	0	112.5	L402 E403 Q404 R410	L402-L406 VanDerWaalsContact O-CG 3.31Å; L402-L406 WeakPolarHBondContact O-CG 3.24Å; L402-L406 PolarHBondContact O-N 3.29Å; E403-L406 PolarHBondContact O-N 2.86Å; Q404-L406 VanDerWaalsContact C-N 3.26Å; Q404-L406 PolarHBondContact O-N 3.01Å; L406-R410 WeakPolarHBondContact O-CB 3.35Å; L406-R410 PolarHBondContact O-N 2.88Å
407	G	98.3	Very high	98.3	Very high	39 Å²	39	101.7 Å²	101.7	40%	0.402	52%	0.515	S	S	.	.	H	α-helix	trans	-64.4	-51.1	168.7	0	0	0	0	0	112.4	E403 Q404 V405 H409 R410 E411	E403-G407 PolarHBondContact O-N 3.34Å; Q404-G407 CarbonylContact O-C 3.56Å; Q404-G407 WeakPolarHBondContact O-CA 3.4Å; Q404-G407 PolarHBondContact O-N 3.02Å; V405-G407 VanDerWaalsContact C-N 3.35Å; G407-H409 VanDerWaalsContact C-N 3.33Å; G407-H409 PolarHBondContact O-N 3.36Å; G407-R410 WeakPolarHBondContact O-CA 3.48Å; G407-R410 WeakPolarHBondContact O-CB 3.49Å; G407-R410 PolarHBondContact O-N 2.87Å; G407-E411 PolarHBondContact O-N 2.98Å
408	D	97.9	Very high	98.3	Very high	84 Å²	84	99.2 Å²	99.2	45%	0.449	51%	0.513	S	S	.	.	H	α-helix	trans	-59.8	-42.8	178	-60.9	-20	0	0	0	111.2	Q404 V405 R410 E411 L412	Q404-D408 PolarHBondContact O-N 3.36Å; V405-D408 PolarHBondContact O-N 3.45Å; D408-R410 VanDerWaalsContact C-N 3.28Å; D408-R410 PolarHBondContact O-N 3.15Å; D408-E411 PolarHBondContact O-N 3.06Å; D408-L412 WeakPolarHBondContact O-CB 3.24Å; D408-L412 PolarHBondContact O-N 3.22Å
409	H	98.5	Very high	98.3	Very high	102 Å²	102	99.8 Å²	99.8	47%	0.472	51%	0.512	S	S	.	.	H	α-helix	trans	-61.7	-34.8	172.1	-73.8	173.1	0	0	0	112.6	V405 G407 I413	V405-H409 WeakPolarHBondContact O-CB 3.48Å; V405-H409 PolarHBondContact O-N 3.07Å; G407-H409 VanDerWaalsContact C-N 3.33Å; G407-H409 PolarHBondContact O-N 3.36Å; H409-I413 WeakPolarHBondContact O-CB 3.39Å; H409-I413 WeakPolarHBondContact O-CD1 3.47Å; H409-I413 VanDerWaalsContact O-CG1 3.23Å; H409-I413 WeakPolarHBondContact O-CG1 3.5Å; H409-I413 PolarHBondContact O-N 3.5Å
410	R	98.4	Very high	98.3	Very high	147 Å²	147	96.4 Å²	96.4	56%	0.555	51%	0.505	S	S	*	.	H	α-helix	trans	-71.8	-42.6	178.2	179.7	58.6	-164.4	-92.9	-4.4	111.8	L406 G407 D408 L412 I413 D414	L406-R410 WeakPolarHBondContact O-CB 3.35Å; L406-R410 PolarHBondContact O-N 2.88Å; G407-R410 WeakPolarHBondContact O-CA 3.48Å; G407-R410 WeakPolarHBondContact O-CB 3.49Å; G407-R410 PolarHBondContact O-N 2.87Å; D408-R410 VanDerWaalsContact C-N 3.28Å; D408-R410 PolarHBondContact O-N 3.15Å; R410-L412 VanDerWaalsContact C-N 3.31Å; R410-L412 PolarHBondContact O-N 3.03Å; R410-I413 PolarHBondContact O-N 3.26Å; R410-D414 IonicContact CZ-OD1 3.2Å; R410-D414 IonicContact CZ-OD2 2.57Å; R410-D414 IonicContact NE-OD1 3.95Å; R410-D414 PolarHBondContact NE-OD1 3.37Å; R410-D414 IonicContact NE-OD2 2.76Å; R410-D414 PolarHBondContact NE-OD2 2.79Å; R410-D414 IonicContact NH2-OD1 2.98Å; R410-D414 PolarHBondContact NH2-OD1 3.41Å; R410-D414 VanDerWaalsContact NH2-OD1 3.11Å; R410-D414 IonicContact NH2-OD2 2.65Å; R410-D414 PolarHBondContact NH2-OD2 2.86Å; R410-D414 VanDerWaalsContact NH2-OD2 3.14Å; R410-D414 PolarHBondContact O-N 3.15Å
411	E	98.3	Very high	98.4	Very high	146 Å²	146	95 Å²	95	68%	0.682	50%	0.501	S	S	*	.	H	α-helix	trans	-59.9	-43.1	173.5	-173.5	174.2	170.3	0	0	110.9	G407 D408 I413 D414 A415	G407-E411 PolarHBondContact O-N 2.98Å; D408-E411 PolarHBondContact O-N 3.06Å; E411-I413 PolarHBondContact O-N 2.64Å; E411-D414 PolarHBondContact O-N 3.19Å; E411-A415 VanDerWaalsContact O-CB 3.28Å; E411-A415 WeakPolarHBondContact O-CB 3.44Å; E411-A415 PolarHBondContact O-N 2.75Å
412	L	98.6	Very high	98.4	Very high	100 Å²	100	95.2 Å²	95.2	52%	0.524	50%	0.497	S	S	.	.	H	α-helix	trans	-60.7	-42.3	174.2	178.7	61.2	0	0	0	112.7	D408 R410 L416	D408-L412 WeakPolarHBondContact O-CB 3.24Å; D408-L412 PolarHBondContact O-N 3.22Å; R410-L412 VanDerWaalsContact C-N 3.31Å; R410-L412 PolarHBondContact O-N 3.03Å; L412-L416 HydrophobicContact CD1-CD1 3.97Å; L412-L416 HydrophobicContact CD1-CG 4.1Å; L412-L416 HydrophobicContact CG-CD1 3.98Å; L412-L416 WeakPolarHBondContact O-CB 3.49Å; L412-L416 VanDerWaalsContact O-CG 3.25Å; L412-L416 WeakPolarHBondContact O-CG 3.1Å; L412-L416 PolarHBondContact O-N 3.22Å
413	I	98.6	Very high	98.4	Very high	95 Å²	95	93.9 Å²	93.9	49%	0.487	49%	0.49	S	S	.	.	H	α-helix	trans	-65.2	-43.8	176.8	-74	163.9	0	0	0	111.3	H409 R410 E411 T417	H409-I413 WeakPolarHBondContact O-CB 3.39Å; H409-I413 WeakPolarHBondContact O-CD1 3.47Å; H409-I413 VanDerWaalsContact O-CG1 3.23Å; H409-I413 WeakPolarHBondContact O-CG1 3.5Å; H409-I413 PolarHBondContact O-N 3.5Å; R410-I413 PolarHBondContact O-N 3.26Å; E411-I413 PolarHBondContact O-N 2.64Å; I413-T417 VanDerWaalsContact O-CB 3.28Å; I413-T417 WeakPolarHBondContact O-CB 3.2Å; I413-T417 PolarHBondContact O-N 3.49Å; I413-T417 PolarHBondContact O-OG1 3.46Å
414	D	98.6	Very high	98.4	Very high	73 Å²	73	95.2 Å²	95.2	39%	0.39	49%	0.489	S	S	.	.	H	α-helix	trans	-68.3	-37.9	179.8	-70.7	-18.2	0	0	0	110.8	R410 E411 T417 A418	R410-D414 IonicContact CZ-OD1 3.2Å; R410-D414 IonicContact CZ-OD2 2.57Å; R410-D414 IonicContact NE-OD1 3.95Å; R410-D414 PolarHBondContact NE-OD1 3.37Å; R410-D414 IonicContact NE-OD2 2.76Å; R410-D414 PolarHBondContact NE-OD2 2.79Å; R410-D414 IonicContact NH2-OD1 2.98Å; R410-D414 PolarHBondContact NH2-OD1 3.41Å; R410-D414 VanDerWaalsContact NH2-OD1 3.11Å; R410-D414 IonicContact NH2-OD2 2.65Å; R410-D414 PolarHBondContact NH2-OD2 2.86Å; R410-D414 VanDerWaalsContact NH2-OD2 3.14Å; R410-D414 PolarHBondContact O-N 3.15Å; E411-D414 PolarHBondContact O-N 3.19Å; D414-T417 PolarHBondContact O-N 2.8Å; D414-A418 PolarHBondContact O-N 2.83Å
415	A	98.6	Very high	98.4	Very high	58 Å²	58	95.6 Å²	95.6	48%	0.479	49%	0.491	S	S	.	.	H	α-helix	trans	-66.6	-44.8	173.9	0	0	0	0	0	113.1	E411 T417 A418 E419	E411-A415 VanDerWaalsContact O-CB 3.28Å; E411-A415 WeakPolarHBondContact O-CB 3.44Å; E411-A415 PolarHBondContact O-N 2.75Å; A415-T417 VanDerWaalsContact C-N 3.28Å; A415-T417 PolarHBondContact O-N 3.35Å; A415-A418 PolarHBondContact O-N 2.86Å; A415-E419 PolarHBondContact O-N 3.35Å
416	L	98.6	Very high	98.3	Very high	95 Å²	95	96.4 Å²	96.4	50%	0.497	49%	0.49	S	S	.	.	H	α-helix	trans	-63.3	-35.6	173.4	-74.2	170.7	0	0	0	111.6	L412 E419 I420	L412-L416 HydrophobicContact CD1-CD1 3.97Å; L412-L416 HydrophobicContact CD1-CG 4.1Å; L412-L416 HydrophobicContact CG-CD1 3.98Å; L412-L416 WeakPolarHBondContact O-CB 3.49Å; L412-L416 VanDerWaalsContact O-CG 3.25Å; L412-L416 WeakPolarHBondContact O-CG 3.1Å; L412-L416 PolarHBondContact O-N 3.22Å; L416-E419 PolarHBondContact O-N 3.35Å; L416-I420 WeakPolarHBondContact O-CB 3.2Å; L416-I420 WeakPolarHBondContact O-CD1 3.38Å; L416-I420 VanDerWaalsContact O-CG1 3.23Å; L416-I420 WeakPolarHBondContact O-CG1 3.4Å; L416-I420 PolarHBondContact O-N 2.82Å
417	T	98.5	Very high	98.3	Very high	68 Å²	68	95.9 Å²	95.9	42%	0.417	49%	0.488	S	S	.	.	H	α-helix	trans	-65.5	-43	175.2	-60.6	0	0	0	0	111	I413 D414 A415 I420 L421	I413-T417 VanDerWaalsContact O-CB 3.28Å; I413-T417 WeakPolarHBondContact O-CB 3.2Å; I413-T417 PolarHBondContact O-N 3.49Å; I413-T417 PolarHBondContact O-OG1 3.46Å; D414-T417 PolarHBondContact O-N 2.8Å; A415-T417 VanDerWaalsContact C-N 3.28Å; A415-T417 PolarHBondContact O-N 3.35Å; T417-I420 PolarHBondContact O-N 2.96Å; T417-L421 HydrophobicContact CG2-CD1 4.32Å; T417-L421 WeakPolarHBondContact O-CG 3.27Å; T417-L421 PolarHBondContact O-N 3.07Å
418	A	98.4	Very high	98.3	Very high	61 Å²	61	96.8 Å²	96.8	50%	0.504	49%	0.491	S	S	.	.	H	α-helix	trans	-60.4	-44.4	174.1	0	0	0	0	0	111.9	D414 A415 L421 R422	D414-A418 PolarHBondContact O-N 2.83Å; A415-A418 PolarHBondContact O-N 2.86Å; A418-L421 PolarHBondContact O-N 3.07Å; A418-R422 WeakPolarHBondContact O-CB 3.23Å; A418-R422 PolarHBondContact O-N 2.92Å
419	E	98.1	Very high	98.3	Very high	76 Å²	76	95.6 Å²	95.6	36%	0.355	49%	0.487	S	S	.	.	H	α-helix	trans	-66.7	-39	177.3	-175.2	57	-156.3	0	0	112.4	A415 L416 L421 R422 L423	A415-E419 PolarHBondContact O-N 3.35Å; L416-E419 PolarHBondContact O-N 3.35Å; E419-L421 VanDerWaalsContact C-N 3.29Å; E419-L421 PolarHBondContact O-N 2.67Å; E419-R422 VanDerWaalsContact CD-NE 3.34Å; E419-R422 WeakPolarHBondContact O-CB 3.36Å; E419-R422 PolarHBondContact O-N 3.29Å; E419-R422 IonicContact OE1-CZ 2.75Å; E419-R422 IonicContact OE1-NE 3.72Å; E419-R422 PolarHBondContact OE1-NE 2.89Å; E419-R422 IonicContact OE1-NH2 3.06Å; E419-R422 PolarHBondContact OE1-NH2 2.89Å; E419-R422 WeakPolarHBondContact OE2-CD 3.49Å; E419-R422 IonicContact OE2-CZ 2.89Å; E419-R422 IonicContact OE2-NE 2.68Å; E419-R422 PolarHBondContact OE2-NE 3.3Å; E419-R422 IonicContact OE2-NH2 3.84Å; E419-L423 HydrophobicContact CG-CD1 4.02Å; E419-L423 HydrophobicContact CG-CG 4.37Å; E419-L423 WeakPolarHBondContact O-CB 3.47Å; E419-L423 VanDerWaalsContact O-CG 3.28Å; E419-L423 WeakPolarHBondContact O-CG 3.45Å; E419-L423 PolarHBondContact O-N 2.96Å; E419-L423 WeakPolarHBondContact OE1-CG 3.35Å
420	I	98.4	Very high	98.3	Very high	86 Å²	86	94.2 Å²	94.2	44%	0.441	49%	0.486	S	S	.	.	H	α-helix	trans	-63.1	-36	174.1	-71.7	164.5	0	0	0	111.5	L416 T417 R424	L416-I420 WeakPolarHBondContact O-CB 3.2Å; L416-I420 WeakPolarHBondContact O-CD1 3.38Å; L416-I420 VanDerWaalsContact O-CG1 3.23Å; L416-I420 WeakPolarHBondContact O-CG1 3.4Å; L416-I420 PolarHBondContact O-N 2.82Å; T417-I420 PolarHBondContact O-N 2.96Å; I420-R424 WeakPolarHBondContact O-CB 3.39Å; I420-R424 VanDerWaalsContact O-CG 3.23Å; I420-R424 WeakPolarHBondContact O-CG 3.36Å; I420-R424 PolarHBondContact O-N 3.05Å; I420-R424 VanDerWaalsContact O-N 3.13Å
421	L	98.4	Very high	98.3	Very high	99 Å²	99	92.2 Å²	92.2	52%	0.518	48%	0.483	S	S	.	.	H	α-helix	trans	-69.5	-44	173.6	-69.5	170.8	0	0	0	111.3	T417 A418 E419 L423 R424 E425	T417-L421 HydrophobicContact CG2-CD1 4.32Å; T417-L421 WeakPolarHBondContact O-CG 3.27Å; T417-L421 PolarHBondContact O-N 3.07Å; A418-L421 PolarHBondContact O-N 3.07Å; E419-L421 VanDerWaalsContact C-N 3.29Å; E419-L421 PolarHBondContact O-N 2.67Å; L421-L423 PolarHBondContact O-N 3.18Å; L421-R424 WeakPolarHBondContact O-CB 3.42Å; L421-R424 PolarHBondContact O-N 3.16Å; L421-E425 PolarHBondContact O-N 2.95Å
422	R	98.3	Very high	98.3	Very high	103 Å²	103	87.7 Å²	87.7	39%	0.389	47%	0.471	S	S	.	.	H	α-helix	trans	-57.9	-47.2	175.9	-159.1	-170.2	73.3	64.9	21.7	111.8	A418 E419 R424 E425 E426	A418-R422 WeakPolarHBondContact O-CB 3.23Å; A418-R422 PolarHBondContact O-N 2.92Å; E419-R422 VanDerWaalsContact CD-NE 3.34Å; E419-R422 WeakPolarHBondContact O-CB 3.36Å; E419-R422 PolarHBondContact O-N 3.29Å; E419-R422 IonicContact OE1-CZ 2.75Å; E419-R422 IonicContact OE1-NE 3.72Å; E419-R422 PolarHBondContact OE1-NE 2.89Å; E419-R422 IonicContact OE1-NH2 3.06Å; E419-R422 PolarHBondContact OE1-NH2 2.89Å; E419-R422 WeakPolarHBondContact OE2-CD 3.49Å; E419-R422 IonicContact OE2-CZ 2.89Å; E419-R422 IonicContact OE2-NE 2.68Å; E419-R422 PolarHBondContact OE2-NE 3.3Å; E419-R422 IonicContact OE2-NH2 3.84Å; R422-R424 VanDerWaalsContact C-N 3.34Å; R422-R424 PolarHBondContact O-N 3.37Å; R422-E425 PolarHBondContact O-N 3.34Å; R422-E426 IonicContact CZ-OE1 3.25Å; R422-E426 IonicContact CZ-OE2 3.65Å; R422-E426 VanDerWaalsContact CZ-OE2 3.27Å; R422-E426 IonicContact NH1-OE1 3.6Å; R422-E426 PolarHBondContact NH1-OE1 3.3Å; R422-E426 IonicContact NH1-OE2 3.26Å; R422-E426 PolarHBondContact NH1-OE2 3.29Å; R422-E426 IonicContact NH2-OE1 2.9Å; R422-E426 IonicContact NH2-OE2 2.66Å; R422-E426 PolarHBondContact NH2-OE2 3Å; R422-E426 WeakPolarHBondContact O-CG 3.43Å; R422-E426 PolarHBondContact O-N 3.21Å
423	L	98.5	Very high	98.2	Very high	84 Å²	84	90.2 Å²	90.2	44%	0.44	47%	0.473	S	S	.	.	H	α-helix	trans	-65.7	-32.8	176.7	-70.6	168.9	0	0	0	112.9	E419 L421 N427	E419-L423 HydrophobicContact CG-CD1 4.02Å; E419-L423 HydrophobicContact CG-CG 4.37Å; E419-L423 WeakPolarHBondContact O-CB 3.47Å; E419-L423 VanDerWaalsContact O-CG 3.28Å; E419-L423 WeakPolarHBondContact O-CG 3.45Å; E419-L423 PolarHBondContact O-N 2.96Å; E419-L423 WeakPolarHBondContact OE1-CG 3.35Å; L421-L423 PolarHBondContact O-N 3.18Å; L423-N427 VanDerWaalsContact O-CB 3.25Å; L423-N427 WeakPolarHBondContact O-CB 3.31Å; L423-N427 PolarHBondContact O-N 3.49Å
424	R	98	Very high	98.2	Very high	169 Å²	169	90.7 Å²	90.7	64%	0.638	48%	0.476	S	S	*	.	H	α-helix	trans	-68.9	-40.2	172.9	-77.9	170.8	179.3	-173.4	2.5	111.9	I420 L421 R422 A428	I420-R424 WeakPolarHBondContact O-CB 3.39Å; I420-R424 VanDerWaalsContact O-CG 3.23Å; I420-R424 WeakPolarHBondContact O-CG 3.36Å; I420-R424 PolarHBondContact O-N 3.05Å; I420-R424 VanDerWaalsContact O-N 3.13Å; L421-R424 WeakPolarHBondContact O-CB 3.42Å; L421-R424 PolarHBondContact O-N 3.16Å; R422-R424 VanDerWaalsContact C-N 3.34Å; R422-R424 PolarHBondContact O-N 3.37Å; R424-A428 WeakPolarHBondContact O-CB 3.3Å; R424-A428 PolarHBondContact O-N 2.96Å
425	E	98.1	Very high	98.2	Very high	137 Å²	137	92.3 Å²	92.3	64%	0.64	48%	0.481	S	S	*	.	H	α-helix	trans	-64.5	-49.2	173.8	-174.8	175.6	-170.3	0	0	110.8	L421 R422 N427 A428 T429	L421-E425 PolarHBondContact O-N 2.95Å; R422-E425 PolarHBondContact O-N 3.34Å; E425-N427 VanDerWaalsContact C-N 3.33Å; E425-N427 PolarHBondContact O-N 2.91Å; E425-A428 WeakPolarHBondContact O-CB 3.48Å; E425-A428 PolarHBondContact O-N 3.5Å; E425-A428 VanDerWaalsContact O-N 3.09Å; E425-T429 WeakPolarHBondContact O-CG2 3.31Å; E425-T429 PolarHBondContact O-N 2.88Å
426	E	97.8	Very high	98.2	Very high	86 Å²	86	95.8 Å²	95.8	40%	0.402	49%	0.488	S	S	.	.	H	α-helix	trans	-54.6	-48.6	175.4	-75	-174.3	141.3	0	0	111.5	R422 A428 T429 T430	R422-E426 IonicContact CZ-OE1 3.25Å; R422-E426 IonicContact CZ-OE2 3.65Å; R422-E426 VanDerWaalsContact CZ-OE2 3.27Å; R422-E426 IonicContact NH1-OE1 3.6Å; R422-E426 PolarHBondContact NH1-OE1 3.3Å; R422-E426 IonicContact NH1-OE2 3.26Å; R422-E426 PolarHBondContact NH1-OE2 3.29Å; R422-E426 IonicContact NH2-OE1 2.9Å; R422-E426 IonicContact NH2-OE2 2.66Å; R422-E426 PolarHBondContact NH2-OE2 3Å; R422-E426 WeakPolarHBondContact O-CG 3.43Å; R422-E426 PolarHBondContact O-N 3.21Å; E426-A428 VanDerWaalsContact C-N 3.33Å; E426-A428 PolarHBondContact O-N 3.11Å; E426-T429 PolarHBondContact O-N 3.09Å; E426-T429 VanDerWaalsContact O-N 3.11Å; E426-T429 PolarHBondContact O-OG1 3.35Å; E426-T430 PolarHBondContact O-N 2.97Å; E426-T430 PolarHBondContact O-OG1 2.79Å
427	N	97.6	Very high	98.1	Very high	106 Å²	106	99.2 Å²	99.2	57%	0.567	50%	0.495	S	S	*	.	H	α-helix	trans	-64.8	-33.4	178.2	-166.4	37.7	0	0	0	113.1	L423 E425 T430 Q431	L423-N427 VanDerWaalsContact O-CB 3.25Å; L423-N427 WeakPolarHBondContact O-CB 3.31Å; L423-N427 PolarHBondContact O-N 3.49Å; E425-N427 VanDerWaalsContact C-N 3.33Å; E425-N427 PolarHBondContact O-N 2.91Å; N427-T430 WeakPolarHBondContact CA-OG1 3.39Å; N427-T430 PolarHBondContact O-OG1 2.84Å; N427-T430 VanDerWaalsContact O-OG1 3.04Å; N427-Q431 VanDerWaalsContact O-CB 3.27Å; N427-Q431 WeakPolarHBondContact O-CB 3.4Å; N427-Q431 PolarHBondContact O-N 3.04Å
428	A	98.2	Very high	98.1	Very high	57 Å²	57	101.6 Å²	101.6	47%	0.471	50%	0.503	S	S	.	.	H	α-helix	trans	-67	-39.8	171.5	0	0	0	0	0	111.6	R424 E425 E426 A432	R424-A428 WeakPolarHBondContact O-CB 3.3Å; R424-A428 PolarHBondContact O-N 2.96Å; E425-A428 WeakPolarHBondContact O-CB 3.48Å; E425-A428 PolarHBondContact O-N 3.5Å; E425-A428 VanDerWaalsContact O-N 3.09Å; E426-A428 VanDerWaalsContact C-N 3.33Å; E426-A428 PolarHBondContact O-N 3.11Å; A428-A432 VanDerWaalsContact O-CB 3.31Å; A428-A432 WeakPolarHBondContact O-CB 3.28Å; A428-A432 PolarHBondContact O-N 2.89Å
429	T	98.3	Very high	98	Very high	60 Å²	60	103.3 Å²	103.3	37%	0.368	51%	0.507	S	S	.	.	H	α-helix	trans	-70	-35.6	176.6	69.2	0	0	0	0	113.1	E425 E426 A432 R433	E425-T429 WeakPolarHBondContact O-CG2 3.31Å; E425-T429 PolarHBondContact O-N 2.88Å; E426-T429 PolarHBondContact O-N 3.09Å; E426-T429 VanDerWaalsContact O-N 3.11Å; E426-T429 PolarHBondContact O-OG1 3.35Å; T429-A432 PolarHBondContact O-N 2.95Å; T429-R433 WeakPolarHBondContact O-CB 3.46Å; T429-R433 VanDerWaalsContact O-CG 3.3Å; T429-R433 WeakPolarHBondContact O-CG 3.38Å; T429-R433 PolarHBondContact O-N 3.41Å
430	T	98.2	Very high	98	Very high	72 Å²	72	102 Å²	102	44%	0.442	51%	0.505	S	S	.	.	H	α-helix	trans	-70.7	-39.4	174.9	56.2	0	0	0	0	111.3	E426 N427 R433 L434	E426-T430 PolarHBondContact O-N 2.97Å; E426-T430 PolarHBondContact O-OG1 2.79Å; N427-T430 WeakPolarHBondContact CA-OG1 3.39Å; N427-T430 PolarHBondContact O-OG1 2.84Å; N427-T430 VanDerWaalsContact O-OG1 3.04Å; T430-R433 PolarHBondContact O-N 3.26Å; T430-L434 WeakPolarHBondContact O-CB 3.25Å; T430-L434 PolarHBondContact O-N 3.48Å
431	Q	98.3	Very high	97.9	Very high	105 Å²	105	101.8 Å²	101.8	49%	0.491	51%	0.507	S	S	.	.	H	α-helix	trans	-63.2	-42.1	172.3	-175.9	175.6	-9.8	0	0	112	N427 L434 Q435	N427-Q431 VanDerWaalsContact O-CB 3.27Å; N427-Q431 WeakPolarHBondContact O-CB 3.4Å; N427-Q431 PolarHBondContact O-N 3.04Å; Q431-L434 WeakPolarHBondContact O-CB 3.44Å; Q431-L434 PolarHBondContact O-N 2.94Å; Q431-Q435 WeakPolarHBondContact O-CG 3.34Å; Q431-Q435 PolarHBondContact O-N 3.34Å
432	A	97.8	Very high	97.8	Very high	51 Å²	51	101.3 Å²	101.3	42%	0.421	51%	0.505	S	S	.	.	H	α-helix	trans	-63.8	-40.6	175.5	0	0	0	0	0	112	A428 T429 Q435 Q436	A428-A432 VanDerWaalsContact O-CB 3.31Å; A428-A432 WeakPolarHBondContact O-CB 3.28Å; A428-A432 PolarHBondContact O-N 2.89Å; T429-A432 PolarHBondContact O-N 2.95Å; A432-Q435 PolarHBondContact O-N 3.41Å; A432-Q436 WeakPolarHBondContact O-CB 3.42Å; A432-Q436 PolarHBondContact O-N 2.97Å
433	R	98.1	Very high	97.7	Very high	153 Å²	153	102.3 Å²	102.3	58%	0.577	51%	0.514	S	S	*	.	H	α-helix	trans	-63.3	-41.3	172.3	-74.8	172.5	-177.5	168.4	4.9	112.1	T429 T430 Q436 Y437	T429-R433 WeakPolarHBondContact O-CB 3.46Å; T429-R433 VanDerWaalsContact O-CG 3.3Å; T429-R433 WeakPolarHBondContact O-CG 3.38Å; T429-R433 PolarHBondContact O-N 3.41Å; T430-R433 PolarHBondContact O-N 3.26Å; R433-Q436 PolarHBondContact O-N 3.44Å; R433-Y437 WeakPolarHBondContact O-CD2 3.46Å; R433-Y437 PolarHBondContact O-N 3.04Å
434	L	98.1	Very high	97.6	Very high	105 Å²	105	104.6 Å²	104.6	55%	0.55	52%	0.522	S	S	.	.	H	α-helix	trans	-60.7	-45.4	175.4	-176	73	0	0	0	111.1	T430 Q431 Y437 M438	T430-L434 WeakPolarHBondContact O-CB 3.25Å; T430-L434 PolarHBondContact O-N 3.48Å; Q431-L434 WeakPolarHBondContact O-CB 3.44Å; Q431-L434 PolarHBondContact O-N 2.94Å; L434-Y437 PolarHBondContact O-N 3.06Å; L434-M438 WeakPolarHBondContact O-CG 3.34Å; L434-M438 PolarHBondContact O-N 2.81Å
435	Q	98	Very high	97.5	Very high	107 Å²	107	101.3 Å²	101.3	50%	0.5	52%	0.517	S	S	.	.	H	α-helix	trans	-62.8	-41.8	175.5	-73.2	176.2	-21.7	0	0	111.9	Q431 A432 M438 V439	Q431-Q435 WeakPolarHBondContact O-CG 3.34Å; Q431-Q435 PolarHBondContact O-N 3.34Å; A432-Q435 PolarHBondContact O-N 3.41Å; Q435-M438 PolarHBondContact O-N 2.91Å; Q435-V439 WeakPolarHBondContact O-CG2 3.23Å; Q435-V439 PolarHBondContact O-N 3.19Å
436	Q	97.8	Very high	97.4	Very high	132 Å²	132	99.5 Å²	99.5	62%	0.617	51%	0.511	S	S	*	.	H	α-helix	trans	-59.8	-47.2	173.6	-174.8	-179.5	3.9	0	0	111.3	A432 R433 M438 V439 T440	A432-Q436 WeakPolarHBondContact O-CB 3.42Å; A432-Q436 PolarHBondContact O-N 2.97Å; R433-Q436 PolarHBondContact O-N 3.44Å; Q436-M438 PolarHBondContact O-N 3.29Å; Q436-V439 PolarHBondContact O-N 3.25Å; Q436-T440 WeakPolarHBondContact O-CG2 3.17Å; Q436-T440 PolarHBondContact O-N 2.71Å; Q436-T440 PolarHBondContact O-OG1 2.88Å
437	Y	98	Very high	97.3	Very high	167 Å²	167	98.7 Å²	98.7	66%	0.655	52%	0.515	S	S	*	.	H	α-helix	trans	-58.2	-49.4	175.6	-80	-60	0	0	0	111.4	R433 L434 V439 T440 T441	R433-Y437 WeakPolarHBondContact O-CD2 3.46Å; R433-Y437 PolarHBondContact O-N 3.04Å; L434-Y437 PolarHBondContact O-N 3.06Å; Y437-V439 PolarHBondContact O-N 2.83Å; Y437-T440 WeakPolarHBondContact CA-OG1 3.45Å; Y437-T440 PolarHBondContact O-N 3.41Å; Y437-T440 VanDerWaalsContact O-N 3.16Å; Y437-T440 PolarHBondContact O-OG1 2.84Å; Y437-T441 PolarHBondContact O-N 3.03Å; Y437-T441 PolarHBondContact O-OG1 3.32Å; Y437-T441 VanDerWaalsContact O-OG1 3.09Å
438	M	97.9	Very high	97.2	Very high	118 Å²	118	98.7 Å²	98.7	58%	0.581	51%	0.514	S	S	*	.	H	α-helix	trans	-54.1	-48.7	177.3	-73.3	177.1	66.5	0	0	112.2	L434 Q435 Q436 T441 D442	L434-M438 WeakPolarHBondContact O-CG 3.34Å; L434-M438 PolarHBondContact O-N 2.81Å; Q435-M438 PolarHBondContact O-N 2.91Å; Q436-M438 PolarHBondContact O-N 3.29Å; M438-T441 WeakPolarHBondContact CA-OG1 3.41Å; M438-T441 PolarHBondContact O-N 3.34Å; M438-T441 PolarHBondContact O-OG1 3.03Å; M438-D442 WeakPolarHBondContact O-CB 3.35Å; M438-D442 PolarHBondContact O-N 3.34Å
439	V	97.4	Very high	97	Very high	97 Å²	97	99.7 Å²	99.7	59%	0.588	51%	0.514	S	S	*	.	H	α-helix	trans	-63.1	-44.2	178	173.3	0	0	0	0	111.2	Q435 Q436 Y437 T441 D442 E443	Q435-V439 WeakPolarHBondContact O-CG2 3.23Å; Q435-V439 PolarHBondContact O-N 3.19Å; Q436-V439 PolarHBondContact O-N 3.25Å; Y437-V439 PolarHBondContact O-N 2.83Å; V439-T441 VanDerWaalsContact C-N 3.33Å; V439-T441 PolarHBondContact O-N 3.47Å; V439-D442 PolarHBondContact O-N 3Å; V439-E443 WeakPolarHBondContact O-CB 3.44Å; V439-E443 PolarHBondContact O-N 3Å
440	T	97.3	Very high	96.7	Very high	49 Å²	49	102.4 Å²	102.4	30%	0.301	52%	0.523	S	S	.	.	H	α-helix	trans	-66.1	-32.6	177.7	56	0	0	0	0	113.2	Q436 Y437 Q444	Q436-T440 WeakPolarHBondContact O-CG2 3.17Å; Q436-T440 PolarHBondContact O-N 2.71Å; Q436-T440 PolarHBondContact O-OG1 2.88Å; Y437-T440 WeakPolarHBondContact CA-OG1 3.45Å; Y437-T440 PolarHBondContact O-N 3.41Å; Y437-T440 VanDerWaalsContact O-N 3.16Å; Y437-T440 PolarHBondContact O-OG1 2.84Å; T440-Q444 WeakPolarHBondContact O-CB 3.4Å; T440-Q444 VanDerWaalsContact O-CG 3.23Å; T440-Q444 WeakPolarHBondContact O-CG 3.25Å; T440-Q444 PolarHBondContact O-N 2.75Å
441	T	96.1	Very high	96.4	Very high	80 Å²	80	101.4 Å²	101.4	49%	0.491	52%	0.522	S	S	.	.	H	α-helix	trans	-73.8	-33.6	174.5	49.6	0	0	0	0	112.5	Y437 M438 V439 L445	Y437-T441 PolarHBondContact O-N 3.03Å; Y437-T441 PolarHBondContact O-OG1 3.32Å; Y437-T441 VanDerWaalsContact O-OG1 3.09Å; M438-T441 WeakPolarHBondContact CA-OG1 3.41Å; M438-T441 PolarHBondContact O-N 3.34Å; M438-T441 PolarHBondContact O-OG1 3.03Å; V439-T441 VanDerWaalsContact C-N 3.33Å; V439-T441 PolarHBondContact O-N 3.47Å; T441-L445 WeakPolarHBondContact O-CB 3.43Å; T441-L445 PolarHBondContact O-N 3.06Å
442	D	97.2	Very high	96	Very high	90 Å²	90	101.7 Å²	101.7	48%	0.481	53%	0.526	S	S	.	.	H	α-helix	trans	-70.8	-43.5	175.2	-166.4	47.6	0	0	0	110.8	M438 V439 Q444 L445 I446	M438-D442 WeakPolarHBondContact O-CB 3.35Å; M438-D442 PolarHBondContact O-N 3.34Å; V439-D442 PolarHBondContact O-N 3Å; D442-Q444 VanDerWaalsContact C-N 3.33Å; D442-Q444 PolarHBondContact O-N 2.76Å; D442-L445 PolarHBondContact O-N 2.92Å; D442-L445 VanDerWaalsContact O-N 3.13Å; D442-I446 WeakPolarHBondContact O-CB 3.36Å; D442-I446 WeakPolarHBondContact O-CD1 3.34Å; D442-I446 VanDerWaalsContact O-CG1 3.23Å; D442-I446 WeakPolarHBondContact O-CG1 3.5Å; D442-I446 PolarHBondContact O-N 3.35Å
443	E	96	Very high	95.5	Very high	123 Å²	123	107.6 Å²	107.6	58%	0.575	54%	0.542	S	S	*	.	H	α-helix	trans	-59.1	-40.8	172.1	-176.2	175.6	-154.3	0	0	112.1	V439 S447	V439-E443 WeakPolarHBondContact O-CB 3.44Å; V439-E443 PolarHBondContact O-N 3Å; E443-S447 VanDerWaalsContact O-CB 3.25Å; E443-S447 WeakPolarHBondContact O-CB 3.3Å; E443-S447 PolarHBondContact O-N 3.22Å; E443-S447 PolarHBondContact O-OG 2.91Å
444	Q	96.3	Very high	94.8	Very high	132 Å²	132	104.9 Å²	104.9	62%	0.617	54%	0.539	S	S	*	.	H	α-helix	trans	-65.8	-40.3	172.5	-77.2	175.5	5.8	0	0	112.7	T440 D442 S447 L448	T440-Q444 WeakPolarHBondContact O-CB 3.4Å; T440-Q444 VanDerWaalsContact O-CG 3.23Å; T440-Q444 WeakPolarHBondContact O-CG 3.25Å; T440-Q444 PolarHBondContact O-N 2.75Å; D442-Q444 VanDerWaalsContact C-N 3.33Å; D442-Q444 PolarHBondContact O-N 2.76Å; Q444-S447 PolarHBondContact O-N 2.89Å; Q444-L448 VanDerWaalsContact O-CB 3.31Å; Q444-L448 WeakPolarHBondContact O-CB 3.41Å; Q444-L448 PolarHBondContact O-N 3.38Å
445	L	96.1	Very high	93.2	Very high	101 Å²	101	103.9 Å²	103.9	53%	0.529	54%	0.54	S	S	.	.	H	α-helix	trans	-67.3	-42.2	177.7	-175.1	154.5	0	0	0	111.8	T441 D442 L448 T449	T441-L445 WeakPolarHBondContact O-CB 3.43Å; T441-L445 PolarHBondContact O-N 3.06Å; D442-L445 PolarHBondContact O-N 2.92Å; D442-L445 VanDerWaalsContact O-N 3.13Å; L445-L448 PolarHBondContact O-N 3.37Å; L445-T449 VanDerWaalsContact O-CB 3.3Å; L445-T449 WeakPolarHBondContact O-CB 3.25Å; L445-T449 PolarHBondContact O-N 3Å; L445-T449 PolarHBondContact O-OG1 3.49Å
446	I	95.8	Very high	91.3	Very high	98 Å²	98	104.2 Å²	104.2	50%	0.503	55%	0.551	S	S	.	*	H	α-helix	trans	-62.8	-45.7	173.3	-68.7	163.7	0	0	0	110	D442 L448 T449 H450	D442-I446 WeakPolarHBondContact O-CB 3.36Å; D442-I446 WeakPolarHBondContact O-CD1 3.34Å; D442-I446 VanDerWaalsContact O-CG1 3.23Å; D442-I446 WeakPolarHBondContact O-CG1 3.5Å; D442-I446 PolarHBondContact O-N 3.35Å; I446-L448 PolarHBondContact O-N 2.91Å; I446-T449 PolarHBondContact O-N 3.26Å; I446-H450 WeakPolarHBondContact O-CB 3.33Å; I446-H450 PolarHBondContact O-N 3.27Å
447	S	94.7	Very high	89.2	Confident	70 Å²	70	104.3 Å²	104.3	49%	0.49	56%	0.561	S	S	.	*	H	α-helix	trans	-61.4	-43.4	177.1	-62.6	0	0	0	0	112.3	E443 Q444 H450 A451	E443-S447 VanDerWaalsContact O-CB 3.25Å; E443-S447 WeakPolarHBondContact O-CB 3.3Å; E443-S447 PolarHBondContact O-N 3.22Å; E443-S447 PolarHBondContact O-OG 2.91Å; Q444-S447 PolarHBondContact O-N 2.89Å; S447-H450 PolarHBondContact O-N 2.98Å; S447-A451 WeakPolarHBondContact O-CB 3.38Å; S447-A451 PolarHBondContact O-N 2.93Å
448	L	95.4	Very high	87.1	Confident	105 Å²	105	103.1 Å²	103.1	55%	0.55	56%	0.564	S	S	.	*	H	α-helix	trans	-64.2	-42.5	175.1	176.7	60.4	0	0	0	111.5	Q444 L445 I446 A451 I452	Q444-L448 VanDerWaalsContact O-CB 3.31Å; Q444-L448 WeakPolarHBondContact O-CB 3.41Å; Q444-L448 PolarHBondContact O-N 3.38Å; L445-L448 PolarHBondContact O-N 3.37Å; I446-L448 PolarHBondContact O-N 2.91Å; L448-A451 PolarHBondContact O-N 3.29Å; L448-I452 HydrophobicContact CD1-CD1 3.97Å; L448-I452 HydrophobicContact CD1-CG1 4.27Å; L448-I452 HydrophobicContact CG-CD1 3.9Å; L448-I452 WeakPolarHBondContact O-CB 3.42Å; L448-I452 VanDerWaalsContact O-CG1 3.26Å; L448-I452 WeakPolarHBondContact O-CG1 3.48Å; L448-I452 PolarHBondContact O-N 2.9Å
449	T	94.1	Very high	84.4	Confident	78 Å²	78	103.9 Å²	103.9	48%	0.479	57%	0.57	S	S	.	*	H	α-helix	trans	-66.4	-38.5	178.4	-61.5	0	0	0	0	111.4	L445 I446 K453	L445-T449 VanDerWaalsContact O-CB 3.3Å; L445-T449 WeakPolarHBondContact O-CB 3.25Å; L445-T449 PolarHBondContact O-N 3Å; L445-T449 PolarHBondContact O-OG1 3.49Å; I446-T449 PolarHBondContact O-N 3.26Å; T449-K453 VanDerWaalsContact O-CB 3.25Å; T449-K453 WeakPolarHBondContact O-CB 3.13Å; T449-K453 PolarHBondContact O-N 3.45Å
450	H	92.5	Very high	82.1	Confident	117 Å²	117	105.9 Å²	105.9	54%	0.542	58%	0.578	S	S	.	*	H	α-helix	trans	-65.9	-42.4	172.6	-177.5	-124.2	0	0	0	111.8	I446 S447 K453 N454	I446-H450 WeakPolarHBondContact O-CB 3.33Å; I446-H450 PolarHBondContact O-N 3.27Å; S447-H450 PolarHBondContact O-N 2.98Å; H450-K453 PolarHBondContact O-N 3.47Å; H450-N454 PolarHBondContact CD2-ND2 3.32Å; H450-N454 PolarHBondContact CE1-ND2 2.97Å; H450-N454 PolarHBondContact NE2-ND2 2.85Å; H450-N454 WeakPolarHBondContact O-CB 3.47Å; H450-N454 PolarHBondContact O-N 3.34Å; H450-N454 PolarHBondContact O-ND2 3.05Å; H450-N454 PolarHBondContact O-OD1 3.36Å
451	A	91.1	Very high	79.7	Confident	52 Å²	52	114 Å²	114	43%	0.43	60%	0.603	S	S	.	*	H	α-helix	trans	-60.7	-47.6	174.5	0	0	0	0	0	111.8	S447 L448 K453 N454 C455	S447-A451 WeakPolarHBondContact O-CB 3.38Å; S447-A451 PolarHBondContact O-N 2.93Å; L448-A451 PolarHBondContact O-N 3.29Å; A451-K453 VanDerWaalsContact C-N 3.34Å; A451-K453 PolarHBondContact O-N 2.91Å; A451-N454 PolarHBondContact O-N 3.42Å; A451-C455 PolarHBondContact O-N 3.3Å; A451-C455 VanDerWaalsContact O-N 3.11Å; A451-C455 PolarHBondContact O-SG 3.4Å; A451-C455 VanDerWaalsContact O-SG 3.35Å
452	I	89.5	Confident	77.5	Confident	111 Å²	111	119.1 Å²	119.1	57%	0.569	62%	0.621	S	S	*	*	H	α-helix	trans	-59.6	-43.6	175.8	-69.7	165.4	0	0	0	111	L448 N454 C455	L448-I452 HydrophobicContact CD1-CD1 3.97Å; L448-I452 HydrophobicContact CD1-CG1 4.27Å; L448-I452 HydrophobicContact CG-CD1 3.9Å; L448-I452 WeakPolarHBondContact O-CB 3.42Å; L448-I452 VanDerWaalsContact O-CG1 3.26Å; L448-I452 WeakPolarHBondContact O-CG1 3.48Å; L448-I452 PolarHBondContact O-N 2.9Å; I452-N454 VanDerWaalsContact C-N 3.25Å; I452-N454 PolarHBondContact O-N 2.9Å; I452-C455 WeakPolarHBondContact O-CB 3.46Å; I452-C455 PolarHBondContact O-N 2.88Å
453	K	88.1	Confident	74.9	Confident	174 Å²	174	123.9 Å²	123.9	76%	0.757	64%	0.641	S	S	*	*	H	α-helix	trans	-66.4	-26	178.9	-172.8	174.8	179.6	-178.7	0	113.3	T449 H450 A451	T449-K453 VanDerWaalsContact O-CB 3.25Å; T449-K453 WeakPolarHBondContact O-CB 3.13Å; T449-K453 PolarHBondContact O-N 3.45Å; H450-K453 PolarHBondContact O-N 3.47Å; A451-K453 VanDerWaalsContact C-N 3.34Å; A451-K453 PolarHBondContact O-N 2.91Å
454	N	82.8	Confident	72.6	Confident	97 Å²	97	125.3 Å²	125.3	52%	0.519	65%	0.651	S	S	.	*	H	α-helix	trans	-95.2	-3.8	179.9	-64.2	-9.4	0	0	0	113.2	H450 A451 I452	H450-N454 PolarHBondContact CD2-ND2 3.32Å; H450-N454 PolarHBondContact CE1-ND2 2.97Å; H450-N454 PolarHBondContact NE2-ND2 2.85Å; H450-N454 WeakPolarHBondContact O-CB 3.47Å; H450-N454 PolarHBondContact O-N 3.34Å; H450-N454 PolarHBondContact O-ND2 3.05Å; H450-N454 PolarHBondContact O-OD1 3.36Å; A451-N454 PolarHBondContact O-N 3.42Å; I452-N454 VanDerWaalsContact C-N 3.25Å; I452-N454 PolarHBondContact O-N 2.9Å
455	C	65.6	Low	70	Confident	83 Å²	83	128.2 Å²	128.2	56%	0.561	66%	0.664	S	S	*	*	S	Bend	trans	-65.9	124.3	166.6	-70.2	0	0	0	0	109.5	A451 I452 V457	A451-C455 PolarHBondContact O-N 3.3Å; A451-C455 VanDerWaalsContact O-N 3.11Å; A451-C455 PolarHBondContact O-SG 3.4Å; A451-C455 VanDerWaalsContact O-SG 3.35Å; I452-C455 WeakPolarHBondContact O-CB 3.46Å; I452-C455 PolarHBondContact O-N 2.88Å; C455-V457 PolarHBondContact O-N 2.93Å
456	P	56.8	Low	67.5	Low	114 Å²	114	128.1 Å²	128.1	74%	0.74	68%	0.678	S	S	*	*			trans	-65	132	176.4	26.7	-33.4	0	0	0	110.2	I458	P456-I458 PolarHBondContact O-N 3.38Å
457	V	55.3	Low	64.8	Low	135 Å²	135	129.3 Å²	129.3	82%	0.818	70%	0.695	S	S	*	*			trans	-65.3	103.6	179.2	178.4	0	0	0	0	109.5	C455 N459	C455-V457 PolarHBondContact O-N 2.93Å; V457-N459 PolarHBondContact O-N 2.88Å
458	I	53.6	Low	62.2	Low	141 Å²	141	135 Å²	135	72%	0.723	71%	0.714	S	S	*	*			trans	-69.5	117	172.1	-55.2	-179.4	0	0	0	107.6	P456 N460	P456-I458 PolarHBondContact O-N 3.38Å; I458-N460 WeakPolarHBondContact CG2-OD1 3.27Å; I458-N460 PolarHBondContact O-N 2.87Å; I458-N460 PolarHBondContact O-OD1 3.26Å
459	N	41.4	Very low	59.3	Low	134 Å²	134	142.1 Å²	142.1	72%	0.717	73%	0.734	S	S	*	*			trans	-93	89.1	-168.9	-155.4	-18.5	0	0	0	109.4	V457 R461	V457-N459 PolarHBondContact O-N 2.88Å; N459-R461 PolarHBondContact O-N 3.36Å
460	N	47.8	Very low	56.3	Low	140 Å²	140	142 Å²	142	75%	0.749	75%	0.748	S	S	*	*			trans	-70	40.3	-166.8	-62.7	-10.2	0	0	0	115.3	I458	I458-N460 WeakPolarHBondContact CG2-OD1 3.27Å; I458-N460 PolarHBondContact O-N 2.87Å; I458-N460 PolarHBondContact O-OD1 3.26Å
461	R	46.9	Very low	53.7	Low	219 Å²	219	140.7 Å²	140.7	83%	0.826	76%	0.757	S	S	*	*			trans	-100.9	-4.3	-166.5	-160.2	173.2	175.8	-163.7	-1.6	115.5	N459	N459-R461 PolarHBondContact O-N 3.36Å
462	Q	50.8	Low	50.9	Low	188 Å²	188	145.3 Å²	145.3	88%	0.879	78%	0.78	S	S	*	*	S	Bend	trans	-117.2	-7.4	-167.3	-77.5	176.8	-34.5	0	0	117
463	E	42.3	Very low	48	Very low	189 Å²	189	143.6 Å²	143.6	88%	0.883	79%	0.79	S	S	*	*	S	Bend	trans	-102.2	24.1	-167.9	-151.3	170	-164.2	0	0	115.6
464	I	47.1	Very low	45.4	Very low	153 Å²	153	144.8 Å²	144.8	79%	0.785	79%	0.79	S	S	*	*	S	Bend	trans	-101.7	-15.9	-175.9	-66.5	173.3	0	0	0	113.4
465	Q	42	Very low	43.2	Very low	193 Å²	193	149.2 Å²	149.2	90%	0.902	80%	0.799	S	S	*	*	S	Bend	trans	-97.3	15.9	-166.9	-62.6	-169.6	-1.6	0	0	116.1
466	A	43.3	Very low	41.6	Very low	99 Å²	99	151.4 Å²	151.4	82%	0.818	81%	0.805	S	S	*	*	S	Bend	trans	-123.2	22.1	-164.9	0	0	0	0	0	116.5
467	S	40.6	Very low	40.5	Very low	124 Å²	124	153.8 Å²	153.8	87%	0.867	81%	0.809	S	S	*	*			trans	-145.2	61.2	-179.3	-158.4	0	0	0	0	115
468	E	40	Very low	39.3	Very low	190 Å²	190	153.7 Å²	153.7	89%	0.888	80%	0.803	S	S	*	*			trans	-146.3	73.9	169.3	-164.1	-179.8	-157.1	0	0	112.9
469	R	34.5	Very low	38.2	Very low	254 Å²	254	151.9 Å²	151.9	96%	0.958	80%	0.803	S	S	*	*			trans	-166.5	131.9	164	-118.3	168.8	-166.3	-107.6	-2.8	115.1
470	G	30.8	Very low	37.9	Very low	75 Å²	75	151.4 Å²	151.4	77%	0.773	81%	0.811	S	S	*	*			trans	78.1	103.7	165.8	0	0	0	0	0	114.7
471	A	37.3	Very low	37.1	Very low	89 Å²	89	153.8 Å²	153.8	74%	0.736	82%	0.817	S	S	*	*			cis	88.6	110	25.6	0	0	0	0	0	116.7
472	T	33.1	Very low	36.3	Very low	149 Å²	149	146.4 Å²	146.4	91%	0.914	81%	0.81	S	S	*	*			trans	64.9	131.3	155	56.1	0	0	0	0	120.8
473	G	27.7	Very low	35.8	Very low	76 Å²	76	143.6 Å²	143.6	78%	0.784	81%	0.808	S	S	*	*			trans	-157.5	-18.1	-177.6	0	0	0	0	0	122.2
474	R	33.4	Very low	35.2	Very low	199 Å²	199	139 Å²	139	75%	0.751	80%	0.802	S	S	*	*			trans	63.7	125.1	176.3	-66.5	-173.6	173.4	-79.7	7.8	120.5
475	R	36	Very low	34.5	Very low	190 Å²	190	138.3 Å²	138.3	72%	0.717	81%	0.805	S	S	*	*				62.4	146	129.2	-66.5	-165.7	-53.9	-174.9	5.7	119.9
476	N	32.1	Very low	34.1	Very low	128 Å²	128	136.9 Å²	136.9	68%	0.684	80%	0.803	S	S	*	*			cis	-152.7	160.3	17.3	-105.8	-13.7	0	0	0	111.2
477	M	35.1	Very low	33.5	Very low	164 Å²	164	136.8 Å²	136.8	81%	0.808	80%	0.803	S	S	*	*			trans	21.1	148.2	150.9	-66.2	-59.2	162.8	0	0	122
478	D	28.5	Very low	33.1	Very low	133 Å²	133	138.3 Å²	138.3	71%	0.711	80%	0.801	S	S	*	*			cis	-154.7	166.1	29.5	-148	-52.8	0	0	0	114.1
479	S	30.7	Very low	32.7	Very low	103 Å²	103	135.5 Å²	135.5	72%	0.72	80%	0.796	S	S	*	*			trans	77.7	118.7	148.9	-71.1	0	0	0	0	123.1
480	S	36.2	Very low	32.5	Very low	125 Å²	125	128.8 Å²	128.8	87%	0.874	79%	0.788	S	S	*	*			trans	65.7	104.4	158.3	-148.2	0	0	0	0	121.1
481	E	30.6	Very low	32.8	Very low	189 Å²	189	131.8 Å²	131.8	88%	0.883	79%	0.791	S	S	*	*			trans	-61.9	158	156.5	-163.3	162.4	-142.7	0	0	111.4
482	G	30.9	Very low	32.6	Very low	65 Å²	65	133.1 Å²	133.1	67%	0.67	79%	0.793	S	S	*	*			cis	-150	-179.6	4.9	0	0	0	0	0	114.3
483	P	39.7	Very low	32.4	Very low	129 Å²	129	132.6 Å²	132.6	84%	0.838	78%	0.783	S	S	*	*			trans	-109.2	173.2	-148.1	40.3	-36.5	0	0	0	117.1
484	A	30.6	Very low	32.7	Very low	91 Å²	91	136.9 Å²	136.9	75%	0.752	79%	0.785	S	S	*	*			trans	-76.9	156.9	177.4	0	0	0	0	0	114.2
485	V	31.7	Very low	32.5	Very low	140 Å²	140	135.6 Å²	135.6	85%	0.848	79%	0.785	S	S	*	*			trans	-122.1	90.7	164.9	-177	0	0	0	0	109.4
486	N	33.4	Very low	32.3	Very low	162 Å²	162	136.4 Å²	136.4	87%	0.866	79%	0.788	S	S	*	*			trans	-124.4	116.3	163.6	-88.2	-15.8	0	0	0	107.3
487	A	30.6	Very low	32.1	Very low	98 Å²	98	138.5 Å²	138.5	81%	0.81	79%	0.794	S	S	*	*			trans	-145.8	132.6	172.4	0	0	0	0	0	110.1
488	N	33.4	Very low	31.7	Very low	155 Å²	155	138 Å²	138	83%	0.829	79%	0.79	S	S	*	*			trans	-107	156.9	177.7	-76.3	-67	0	0	0	110.2
489	V	30.1	Very low	31.6	Very low	131 Å²	131	140.4 Å²	140.4	79%	0.794	80%	0.797	S	S	*	*			trans	48.5	112.7	144.1	175.6	0	0	0	0	118.1
490	S	30.6	Very low	31.5	Very low	113 Å²	113	141.5 Å²	141.5	79%	0.79	80%	0.799	S	S	*	*				-176.6	150.9	118.7	-81	0	0	0	0	112.8
491	V	37.3	Very low	31.2	Very low	138 Å²	138	141.1 Å²	141.1	84%	0.836	79%	0.791	S	S	*	*			trans	-115.9	133.1	168.1	173	0	0	0	0	108.5
492	P	32.4	Very low	30.9	Very low	118 Å²	118	140.1 Å²	140.1	77%	0.766	79%	0.786	S	S	*	*			trans	-101.5	127.6	161.1	3.1	17.5	0	0	0	111.1
493	L	29.8	Very low	30.7	Very low	137 Å²	137	146.9 Å²	146.9	72%	0.717	80%	0.798	S	S	*	*			trans	-80.4	137.7	165.1	173.1	66.3	0	0	0	109.3	F495	L493-F495 HydrophobicContact CD2-CD2 3.99Å; L493-F495 HydrophobicContact CD2-CE2 4.05Å; L493-F495 HydrophobicContact CG-CD2 4.31Å
494	M	33.6	Very low	30.5	Very low	167 Å²	167	145.3 Å²	145.3	82%	0.823	79%	0.787	S	S	*	*			trans	-118.4	114.2	165.6	-77.7	-62.6	-61.1	0	0	110.1
495	F	29.1	Very low	30.2	Very low	172 Å²	172	148.1 Å²	148.1	75%	0.754	79%	0.785	S	S	*	*			trans	-79.2	143.4	158.7	-99.9	-98.4	0	0	0	109.4	L493	L493-F495 HydrophobicContact CD2-CD2 3.99Å; L493-F495 HydrophobicContact CD2-CE2 4.05Å; L493-F495 HydrophobicContact CG-CD2 4.31Å
496	R	31.1	Very low	29.9	Very low	207 Å²	207	148.7 Å²	148.7	78%	0.781	78%	0.778	S	S	*	*			trans	-137.6	144.2	152.1	-157.5	176	-161.4	-71.2	-3.4	108.3	E498	R496-E498 IonicContact CZ-OE2 3.88Å; R496-E498 IonicContact NH1-OE2 2.68Å; R496-E498 PolarHBondContact NH1-OE2 2.99Å
497	E	28.2	Very low	29.6	Very low	171 Å²	171	149.6 Å²	149.6	80%	0.799	78%	0.777	S	S	*	*			trans	-130.7	126.5	-161	172	-177.7	-161.8	0	0	108.7
498	E	26.9	Very low	29.4	Very low	154 Å²	154	152.3 Å²	152.3	72%	0.72	78%	0.777	S	S	*	*			trans	175.3	130	168.4	-100.5	154.8	153.8	0	0	106.2	R496	R496-E498 IonicContact CZ-OE2 3.88Å; R496-E498 IonicContact NH1-OE2 2.68Å; R496-E498 PolarHBondContact NH1-OE2 2.99Å
499	E	26.6	Very low	30.2	Very low	184 Å²	184	150.2 Å²	150.2	86%	0.86	77%	0.772	S	S	*	*			cis	-151.1	179.5	-9.4	-144.5	-176.1	174.7	0	0	111
500	V	29.5	Very low	30	Very low	125 Å²	125	150.5 Å²	150.5	76%	0.758	77%	0.774	S	S	*	*			trans	-75.3	153	-170.4	-177.9	0	0	0	0	112.8
501	V	28.3	Very low	29.8	Very low	117 Å²	117	153.2 Å²	153.2	71%	0.709	77%	0.771	S	S	*	*				169.7	134.7	123.1	156.6	0	0	0	0	113.3
502	E	25.6	Very low	29.3	Very low	169 Å²	169	154.1 Å²	154.1	79%	0.79	77%	0.771	S	S	*	*			trans	36.4	131.6	159.7	-68.2	173.7	119.7	0	0	123.9
503	F	25.9	Very low	28.9	Very low	207 Å²	207	152.8 Å²	152.8	91%	0.908	76%	0.764	S	S	*	*			trans	-97.6	147	135.3	-93.1	-84.3	0	0	0	108.2
504	P	35.9	Very low	28.8	Very low	96 Å²	96	154.8 Å²	154.8	62%	0.623	77%	0.77	S	S	*	*				-146.7	159.9	108.5	38.7	-25.2	0	0	0	116.3
505	Q	23.9	Very low	28.6	Very low	149 Å²	149	152.2 Å²	152.2	70%	0.696	76%	0.763	S	S	*	*			trans	56.7	146.6	150.9	-86.1	170.5	-98.1	0	0	122.8
506	E	26.2	Very low	28.8	Very low	153 Å²	153	150 Å²	150	72%	0.715	77%	0.766	S	S	*	*			trans	60	157	149.7	-85.8	125.3	-128.4	0	0	119.5
507	E	26.3	Very low	28.6	Very low	180 Å²	180	146.8 Å²	146.8	84%	0.841	77%	0.765	S	S	*	*			cis	-146.3	-172.4	-21	-143.4	-170.7	146.5	0	0	109.1
508	L	26.5	Very low	29.5	Very low	155 Å²	155	143.9 Å²	143.9	81%	0.812	76%	0.761	S	S	*	*			trans	-86.3	-174.2	168.7	-74.1	166.6	0	0	0	110.7
509	P	50.2	Low	30.1	Very low	111 Å²	111	142.3 Å²	142.3	72%	0.721	76%	0.764	S	S	*	*				-128.1	172.9	-91.6	37.6	-19.5	0	0	0	113.3
510	V	25.4	Very low	30.1	Very low	137 Å²	137	140.3 Å²	140.3	83%	0.83	76%	0.759	S	S	*	*			trans	-168.9	151.8	151.9	128.9	0	0	0	0	109
511	K	27.8	Very low	29.9	Very low	170 Å²	170	141.3 Å²	141.3	74%	0.739	76%	0.76	S	S	*	*			cis	142.4	146.7	-9.4	-154.1	-178.8	-171.3	179.2	0	105.2
512	L	26.2	Very low	30	Very low	157 Å²	157	143.3 Å²	143.3	82%	0.822	76%	0.764	S	S	*	*			trans	73.7	147.8	169.9	-58.5	177	0	0	0	115.6
513	S	24.6	Very low	30.1	Very low	91 Å²	91	141.2 Å²	141.2	64%	0.636	76%	0.762	S	S	*	*			cis	-164.2	178.1	-14.1	-160.5	0	0	0	0	112.3
514	Q	27.3	Very low	30.4	Very low	179 Å²	179	139.1 Å²	139.1	84%	0.836	76%	0.76	S	S	*	*			trans	81.2	134.8	155.5	-77.2	159.2	47.3	0	0	121.2
515	V	28.7	Very low	29.9	Very low	112 Å²	112	138.4 Å²	138.4	68%	0.679	76%	0.762	S	S	*	*			trans	-117.8	148.8	167.3	171.2	0	0	0	0	106.5
516	P	34.2	Very low	30.3	Very low	126 Å²	126	140.6 Å²	140.6	82%	0.818	77%	0.769	S	S	*	*			trans	-136.7	138.5	132.3	23.6	-4.9	0	0	0	114
517	D	26.4	Very low	30.5	Very low	139 Å²	139	140.5 Å²	140.5	74%	0.743	77%	0.774	S	S	*	*			trans	-87	-166.8	166.3	-52.6	-76.7	0	0	0	110.7
518	P	46.1	Very low	30.7	Very low	110 Å²	110	141.6 Å²	141.6	71%	0.714	78%	0.776	S	S	*	*				-117.5	-162.1	-77.8	38.2	-22.9	0	0	0	111.4
519	P	39.7	Very low	31.7	Very low	122 Å²	122	140.1 Å²	140.1	79%	0.792	78%	0.776	S	S	*	*				-145.3	171.3	115.9	38.3	-23.8	0	0	0	116.4
520	D	26.6	Very low	30.6	Very low	141 Å²	141	139.1 Å²	139.1	75%	0.754	78%	0.777	S	S	*	*			trans	-74.8	155.7	-169.8	-39.8	-88.9	0	0	0	116.1
521	N	27.1	Very low	31	Very low	146 Å²	146	140.6 Å²	140.6	78%	0.781	78%	0.775	S	S	*	*				171.4	159.3	96.7	65.4	72.8	0	0	0	117.3
522	M	29.2	Very low	31.2	Very low	160 Å²	160	139 Å²	139	79%	0.788	77%	0.772	S	S	*	*			trans	52.3	98.4	152	-70.7	174.6	62.8	0	0	124.1
523	T	28.1	Very low	31.6	Very low	124 Å²	124	141.6 Å²	141.6	76%	0.761	78%	0.778	S	S	*	*				23.6	126.6	121.6	58	0	0	0	0	121.9
524	L	31.5	Very low	32.1	Very low	164 Å²	164	145.7 Å²	145.7	86%	0.859	79%	0.787	S	S	*	*				161.9	123.6	95	-174.7	61.4	0	0	0	115.1
525	A	26.2	Very low	32.9	Very low	81 Å²	81	142.4 Å²	142.4	67%	0.669	78%	0.781	S	S	*	*			trans	40.7	130.6	153.5	0	0	0	0	0	123.8
526	K	31.2	Very low	33.3	Very low	194 Å²	194	141.8 Å²	141.8	84%	0.843	79%	0.788	S	S	*	*				-169.2	115.8	121.6	-104.7	162.3	-173	175.5	0	114.3
527	N	31	Very low	33.5	Very low	152 Å²	152	141.2 Å²	141.2	81%	0.813	78%	0.782	S	S	*	*			trans	40.5	125.7	143.9	-52.3	-12.2	0	0	0	122.3
528	F	31.7	Very low	34.4	Very low	203 Å²	203	141.7 Å²	141.7	89%	0.89	78%	0.784	S	S	*	*			trans	-84.1	-167.7	167	-50.3	-92.7	0	0	0	112.2
529	P	46.7	Very low	34.2	Very low	123 Å²	123	144.5 Å²	144.5	80%	0.799	79%	0.792	S	S	*	*			cis	-132.8	165.5	-15.1	36.5	-19.4	0	0	0	115.9
530	A	28	Very low	34.6	Very low	91 Å²	91	143.8 Å²	143.8	75%	0.752	79%	0.785	S	S	*	*			trans	-161.2	118.1	153.7	0	0	0	0	0	114.7
531	H	32.1	Very low	35.7	Very low	168 Å²	168	142.2 Å²	142.2	78%	0.778	78%	0.782	S	S	*	*			trans	29.6	116.6	151	-61.1	-76.4	0	0	0	124.5
532	I	33.3	Very low	36.4	Very low	135 Å²	135	141 Å²	141	69%	0.692	78%	0.783	S	S	*	*				45.8	111	118.3	-52.9	167.3	0	0	0	118.3
533	F	34.6	Very low	36.8	Very low	212 Å²	212	144.6 Å²	144.6	93%	0.93	79%	0.787	S	S	*	*				-160.3	117.8	120.7	-97.8	-67.5	0	0	0	109.3
534	E	34.1	Very low	37.3	Very low	177 Å²	177	147.9 Å²	147.9	83%	0.827	79%	0.794	S	S	*	*			trans	-114.4	126.7	176.5	-172	172.4	-134.6	0	0	109.8
535	P	43.4	Very low	37.3	Very low	110 Å²	110	149.1 Å²	149.1	71%	0.714	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-78	144.7	-179.6	31.2	-34.1	0	0	0	112	V537	P535-V537 PolarHBondContact O-N 3.37Å
536	A	37.7	Very low	37.4	Very low	100 Å²	100	151.2 Å²	151.2	83%	0.826	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-58.9	123.6	-171.8	0	0	0	0	0	114	L538	A536-L538 PolarHBondContact O-N 3.04Å
537	V	39.1	Very low	37.3	Very low	113 Å²	113	149.2 Å²	149.2	69%	0.685	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-78.4	118.1	178.8	177	0	0	0	0	111	P535 L539	P535-V537 PolarHBondContact O-N 3.37Å; V537-L539 HydrophobicContact CG1-CD2 4.45Å; V537-L539 PolarHBondContact O-N 2.88Å
538	L	45.5	Very low	37.4	Very low	150 Å²	150	149.5 Å²	149.5	79%	0.785	80%	0.802	S	S	*	*			trans	-68.5	109.4	168.3	-87.3	79.5	0	0	0	110.3	A536 T540	A536-L538 PolarHBondContact O-N 3.04Å; L538-T540 PolarHBondContact O-N 3.4Å
539	L	41.3	Very low	37.2	Very low	169 Å²	169	149.6 Å²	149.6	89%	0.885	80%	0.802	S	S	*	*			trans	-75.3	69.4	170.8	-68.6	178.5	0	0	0	112	V537	V537-L539 HydrophobicContact CG1-CD2 4.45Å; V537-L539 PolarHBondContact O-N 2.88Å
540	T	49	Very low	36.3	Very low	107 Å²	107	153.2 Å²	153.2	66%	0.656	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-98.4	123.8	160.2	-55.3	0	0	0	0	108.6	L538	L538-T540 PolarHBondContact O-N 3.4Å
541	P	48.9	Very low	36.3	Very low	107 Å²	107	154.2 Å²	154.2	70%	0.695	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-62.9	140.3	-176.9	23.3	-32.7	0	0	0	112.2	R543	P541-R543 PolarHBondContact O-N 3.4Å
542	P	40.8	Very low	36.7	Very low	121 Å²	121	151.7 Å²	151.7	79%	0.786	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-73.9	118.7	-164.1	27.1	-35.2	0	0	0	113.5	Q544	P542-Q544 PolarHBondContact O-N 3.48Å
543	R	38.6	Very low	36.5	Very low	235 Å²	235	152.7 Å²	152.7	89%	0.887	81%	0.811	S	S	*	*			trans	-75.9	98.5	169.3	-65.8	179.3	67.5	-166.5	2.6	110.1	P541 K545	P541-R543 PolarHBondContact O-N 3.4Å; R543-K545 PolarHBondContact O-N 3.4Å
544	Q	38.6	Very low	36.4	Very low	193 Å²	193	150.2 Å²	150.2	90%	0.902	80%	0.802	S	S	*	*			trans	-58.4	124.5	175.5	-69.4	-179.4	-37.3	0	0	111.4	P542	P542-Q544 PolarHBondContact O-N 3.48Å
545	K	32.1	Very low	36.6	Very low	190 Å²	190	149.7 Å²	149.7	83%	0.826	81%	0.805	S	S	*	*			trans	-104.2	105.3	174.5	-67.4	178.5	-179.2	175.5	0	109.3	R543 N547	R543-K545 PolarHBondContact O-N 3.4Å; K545-N547 PolarHBondContact O-N 2.87Å; K545-N547 VanDerWaalsContact O-N 3.16Å
546	S	28.4	Very low	36.3	Very low	125 Å²	125	150.3 Å²	150.3	87%	0.874	81%	0.807	S	S	*	*			trans	-81.6	88.6	179	41.8	0	0	0	0	112.3
547	N	29.2	Very low	36.2	Very low	153 Å²	153	153.5 Å²	153.5	82%	0.818	81%	0.809	S	S	*	*			trans	-93.3	105.5	164.9	-80.6	-38.3	0	0	0	110	K545	K545-N547 PolarHBondContact O-N 2.87Å; K545-N547 VanDerWaalsContact O-N 3.16Å
548	L	32.8	Very low	35.9	Very low	158 Å²	158	160.1 Å²	160.1	83%	0.827	82%	0.822	S	S	*	*			trans	-149.2	126.2	163.9	-110.7	169.6	0	0	0	110.7
549	K	27.5	Very low	35.3	Very low	204 Å²	204	164.4 Å²	164.4	89%	0.887	83%	0.827	S	S	*	*			trans	-84.3	134.5	172	-64.7	172.1	-179.8	172.7	0	108.4
550	F	28.2	Very low	34.7	Very low	200 Å²	200	162.9 Å²	162.9	88%	0.877	83%	0.825	S	S	*	*			trans	-91.5	141.9	167.2	-85.1	-87.4	0	0	0	111
551	S	26.9	Very low	33.8	Very low	111 Å²	111	164 Å²	164	78%	0.776	83%	0.832	S	S	*	*			trans	-104.1	147.2	163.1	-158.7	0	0	0	0	108.2
552	P	40.4	Very low	32.9	Very low	116 Å²	116	167.7 Å²	167.7	75%	0.753	84%	0.84	S	S	*	*			trans	-91.2	147.7	-162.7	35	-35.2	0	0	0	113.9
553	L	29.2	Very low	32.4	Very low	155 Å²	155	168.9 Å²	168.9	81%	0.812	85%	0.845	S	S	*	*			trans	-161.8	147.9	154.9	-113.5	161.8	0	0	0	110.4
554	Q	33	Very low	32	Very low	161 Å²	161	169 Å²	169	75%	0.752	85%	0.845	S	S	*	*			trans	66.4	81.8	175.1	-51.1	-58.1	-10.1	0	0	117.6	V556	Q554-V556 PolarHBondContact O-N 3.49Å
555	D	37.8	Very low	31.7	Very low	166 Å²	166	165.4 Å²	165.4	89%	0.888	84%	0.839	S	S	*	*			trans	-63.9	111.2	150.1	-77.2	-71.6	0	0	0	111.6
556	V	38.1	Very low	31.4	Very low	123 Å²	123	161 Å²	161	75%	0.745	84%	0.838	S	S	*	*			trans	-149.5	158.8	136.8	-156.7	0	0	0	0	108.4	Q554	Q554-V556 PolarHBondContact O-N 3.49Å
557	L	34.9	Very low	31.6	Very low	166 Å²	166	161.1 Å²	161.1	87%	0.869	84%	0.836	S	S	*	*			trans	69.5	47.9	168.2	-53.1	-178	0	0	0	117.7
558	R	33.1	Very low	31.4	Very low	252 Å²	252	164.8 Å²	164.8	95%	0.951	84%	0.838	S	S	*	*			trans	-126.4	76.4	154.6	-68.4	-165.4	-172.9	-164	5.5	113.1
559	R	32.3	Very low	31.4	Very low	241 Å²	241	164 Å²	164	91%	0.909	83%	0.834	S	S	*	*			trans	-122.1	95.6	162.2	-86.5	-167.7	173.7	117	-1.5	111
560	T	29.5	Very low	32.3	Very low	136 Å²	136	159.7 Å²	159.7	83%	0.834	83%	0.827	S	S	*	*	S	Bend		173	135.6	129.4	29.7	0	0	0	0	110.9
561	V	29.3	Very low	32.5	Very low	132 Å²	132	155.5 Å²	155.5	80%	0.8	82%	0.82	S	S	*	*			trans	43.4	83.6	159.5	-169	0	0	0	0	115.5
562	Q	29.3	Very low	32.3	Very low	184 Å²	184	156.1 Å²	156.1	86%	0.86	82%	0.819	S	S	*	*				43.1	107.9	69.9	-71.8	-161.8	20.6	0	0	116.1
563	T	30.5	Very low	31.7	Very low	145 Å²	145	156 Å²	156	89%	0.89	82%	0.816	S	S	*	*			trans	-118.9	148.2	147.7	50.5	0	0	0	0	108.2
564	R	30.1	Very low	31.6	Very low	237 Å²	237	156.4 Å²	156.4	89%	0.894	81%	0.813	S	S	*	*			trans	-111.3	135.2	-166.7	-168	177.7	-177.1	173.8	1.5	112.2
565	P	33	Very low	31.4	Very low	118 Å²	118	155 Å²	155	77%	0.766	81%	0.81	S	S	*	*			trans	-75.1	161.6	172.6	-14.8	30.3	0	0	0	113.6
566	A	25.8	Very low	31.2	Very low	99 Å²	99	154.2 Å²	154.2	82%	0.818	80%	0.804	S	S	*	*			trans	-95.9	142.9	175.3	0	0	0	0	0	112.9
567	P	32	Very low	30.8	Very low	126 Å²	126	157.9 Å²	157.9	82%	0.818	81%	0.813	S	S	*	*			trans	-102.9	-173.7	177.9	38.3	-31.5	0	0	0	114.2
568	R	26.6	Very low	30.5	Very low	230 Å²	230	158 Å²	158	87%	0.868	81%	0.807	S	S	*	*			trans	-149.1	156.4	-174.9	-73.1	-171.6	168.3	-163.9	-3.4	111
569	L	31.9	Very low	30.2	Very low	143 Å²	143	152.9 Å²	152.9	75%	0.749	79%	0.793	S	S	*	*			cis	-147.7	-59.5	-10.5	-122.5	171.2	0	0	0	114
570	P	45.7	Very low	30.1	Very low	113 Å²	113	149.7 Å²	149.7	73%	0.734	79%	0.789	S	S	*	*			trans	-118.2	168.6	-164.3	34.5	-15	0	0	0	113.1
571	P	32.5	Very low	29.9	Very low	112 Å²	112	150.3 Å²	150.3	73%	0.727	79%	0.787	S	S	*	*			cis	-151.8	173.6	43.6	46	-25.3	0	0	0	120.3
572	T	23.8	Very low	29.7	Very low	123 Å²	123	156.1 Å²	156.1	76%	0.755	80%	0.795	S	S	*	*			trans	66.5	101	137.9	-65	0	0	0	0	122.8
573	V	27.3	Very low	29.6	Very low	114 Å²	114	154.6 Å²	154.6	69%	0.691	79%	0.788	S	S	*	*				77.9	131.5	118.4	171.2	0	0	0	0	123.3
574	E	26.7	Very low	29.5	Very low	163 Å²	163	157 Å²	157	76%	0.762	79%	0.789	S	S	*	*			trans	90.3	150.6	146.7	-96.4	159.9	-131.7	0	0	126.4
575	I	29.6	Very low	29.3	Very low	133 Å²	133	153.2 Å²	153.2	68%	0.682	78%	0.779	S	S	*	*			trans	60.5	97.4	160.7	-62.2	153.7	0	0	0	115.6
576	I	34.3	Very low	29	Very low	149 Å²	149	154.1 Å²	154.1	76%	0.764	78%	0.782	S	S	*	*				63.3	104.7	70.2	-55.6	165.3	0	0	0	112.9
577	E	28	Very low	29.3	Very low	199 Å²	199	157.2 Å²	157.2	93%	0.93	78%	0.784	S	S	*	*				-157.7	-179.7	128.6	-118.8	171.5	-161.6	0	0	112.1
578	K	30.3	Very low	29.6	Very low	170 Å²	170	156.5 Å²	156.5	74%	0.739	78%	0.78	S	S	*	*			trans	-114.7	175.2	-143.5	-174.3	-166.3	160.6	-130.4	0	112.3
579	E	25.9	Very low	29.5	Very low	144 Å²	144	151.5 Å²	151.5	67%	0.673	78%	0.775	S	S	*	*			trans	88.2	142.6	163.2	-48.4	-163.3	155.7	0	0	116.5
580	Q	30	Very low	29.2	Very low	173 Å²	173	151 Å²	151	81%	0.808	77%	0.772	S	S	*	*			cis	-144.1	154.5	-2.8	-154.7	170.2	-2.7	0	0	112
581	N	25	Very low	28.4	Very low	150 Å²	150	151.1 Å²	151.1	80%	0.802	77%	0.771	S	S	*	*	P	Polyproline II helix	trans	-76	159	173.8	-64.6	-26	0	0	0	112.4
582	W	25.6	Very low	28.2	Very low	254 Å²	254	152.3 Å²	152.3	96%	0.962	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-101.9	147.5	149.2	-75.2	108.2	0	0	0	109.9
583	E	27.3	Very low	28.6	Very low	151 Å²	151	152.6 Å²	152.6	71%	0.706	77%	0.767	S	S	*	*	P	Polyproline II helix	trans	-79.6	148.4	-162	-56.8	-175.8	151.6	0	0	115	K585	E583-K585 IonicContact OE2-NZ 2.63Å; E583-K585 PolarHBondContact OE2-NZ 2.81Å
584	E	28	Very low	28.7	Very low	196 Å²	196	155.5 Å²	155.5	92%	0.916	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-71.6	134.2	163.8	-55.3	178.4	127	0	0	111
585	K	27.2	Very low	28.7	Very low	157 Å²	157	154.2 Å²	154.2	68%	0.683	77%	0.772	S	S	*	*			trans	-142.7	121.2	155.7	-68.4	-164	170.4	90.9	0	112.6	E583	E583-K585 IonicContact OE2-NZ 2.63Å; E583-K585 PolarHBondContact OE2-NZ 2.81Å
586	T	25.5	Very low	28.8	Very low	137 Å²	137	153.1 Å²	153.1	84%	0.84	78%	0.775	S	S	*	*			trans	57.4	109.6	151	55.6	0	0	0	0	120.8
587	L	31.7	Very low	28.6	Very low	165 Å²	165	151.6 Å²	151.6	86%	0.864	78%	0.778	S	S	*	*			trans	-59.5	160.4	137.8	-70.4	173.8	0	0	0	110
588	P	38.6	Very low	28.9	Very low	111 Å²	111	151.8 Å²	151.8	72%	0.721	78%	0.779	S	S	*	*			cis	-153.3	-176.6	40.1	44	-22.9	0	0	0	119.6
589	V	24.8	Very low	29.3	Very low	125 Å²	125	152.8 Å²	152.8	76%	0.758	79%	0.786	S	S	*	*			trans	88	130.3	143.7	146.1	0	0	0	0	121.2
590	D	25.6	Very low	29.8	Very low	132 Å²	132	153.3 Å²	153.3	71%	0.706	79%	0.794	S	S	*	*			trans	67.5	112.5	156.4	-68.7	10.7	0	0	0	125.2
591	T	29.5	Very low	30.2	Very low	115 Å²	115	156.6 Å²	156.6	71%	0.706	80%	0.799	S	S	*	*				62.1	122.4	115.7	-37.1	0	0	0	0	117.7
592	D	27.7	Very low	30.9	Very low	138 Å²	138	157.8 Å²	157.8	74%	0.738	80%	0.804	S	S	*	*			cis	-167.8	172.2	26	-153.4	-7.4	0	0	0	114.6
593	I	31.8	Very low	31.4	Very low	128 Å²	128	155.7 Å²	155.7	66%	0.656	80%	0.802	S	S	*	*			trans	52	109.3	161.7	-33.6	-177.5	0	0	0	120.2
594	Q	29.7	Very low	31.8	Very low	176 Å²	176	155 Å²	155	82%	0.822	81%	0.809	S	S	*	*				-177.4	115.9	112.3	-98.3	-171.7	9.8	0	0	116.1
595	N	27.5	Very low	32.2	Very low	136 Å²	136	155.1 Å²	155.1	73%	0.727	81%	0.809	S	S	*	*			trans	39.2	115.7	138.6	-63.3	-11	0	0	0	123.9
596	S	30.5	Very low	32.6	Very low	109 Å²	109	158.7 Å²	158.7	76%	0.762	82%	0.818	S	S	*	*				60.5	115.8	128.1	68.3	0	0	0	0	122.5
597	S	31.3	Very low	32.8	Very low	118 Å²	118	164.5 Å²	164.5	83%	0.825	83%	0.825	S	S	*	*			trans	-170.2	69.4	139.2	58.6	0	0	0	0	113	E599	S597-E599 PolarHBondContact O-N 3.15Å
598	E	34.3	Very low	32.9	Very low	203 Å²	203	167.9 Å²	167.9	95%	0.949	83%	0.826	S	S	*	*			trans	-99.6	63.9	-176.9	-70.1	-176.6	-129	0	0	113.8
599	E	37.7	Very low	32.5	Very low	191 Å²	191	169 Å²	169	89%	0.893	83%	0.831	S	S	*	*	S	Bend	trans	-140.3	14.7	179.8	-144.7	-168.3	156.9	0	0	115.6	S597	S597-E599 PolarHBondContact O-N 3.15Å
600	N	37.7	Very low	32.8	Very low	155 Å²	155	168.1 Å²	168.1	83%	0.829	83%	0.83	S	S	*	*	S	Bend	trans	-140.6	36.2	-166.9	-144.5	-13.3	0	0	0	116.5
601	R	37.3	Very low	32.9	Very low	242 Å²	242	170.2 Å²	170.2	91%	0.913	84%	0.835	S	S	*	*			trans	-141.4	35.6	-177.7	-76.5	-165.5	171.3	-113.5	-1.1	117
602	L	39.8	Very low	33.2	Very low	175 Å²	175	173.7 Å²	173.7	92%	0.916	85%	0.846	S	S	*	*			trans	-127.7	39.5	177.9	-74.3	178.3	0	0	0	115.6
603	F	35.9	Very low	33.3	Very low	209 Å²	209	170.7 Å²	170.7	92%	0.917	85%	0.848	S	S	*	*	S	Bend	trans	-130.7	17	-179.3	-120.6	-84.1	0	0	0	116.8
604	T	36	Very low	33.5	Very low	137 Å²	137	174.1 Å²	174.1	84%	0.84	86%	0.861	S	S	*	*	S	Bend	trans	-137.3	16.9	-171.2	-24.7	0	0	0	0	115.6
605	Q	35.3	Very low	33.5	Very low	199 Å²	199	173.3 Å²	173.3	93%	0.93	86%	0.862	S	S	*	*	S	Bend	trans	-138	63.1	178.3	-67.8	-158.8	47.3	0	0	113.8
606	R	36.1	Very low	33.7	Very low	232 Å²	232	174 Å²	174	88%	0.875	87%	0.865	S	S	*	*	S	Bend	trans	-145.3	13	167.1	-138.6	178.4	-169.3	-107.2	0.5	116.7
607	W	30.6	Very low	33.8	Very low	259 Å²	259	175.8 Å²	175.8	98%	0.981	86%	0.861	S	S	*	*			trans	-134.3	72.5	178.7	-66.3	115.6	0	0	0	111.1
608	R	33.8	Very low	33.6	Very low	236 Å²	236	176 Å²	176	89%	0.891	85%	0.853	S	S	*	*			trans	-146.3	146	167.8	-157.6	-166.4	-65.3	-161.6	2.7	110
609	V	29.8	Very low	33.3	Very low	135 Å²	135	175 Å²	175	82%	0.818	85%	0.846	S	S	*	*			trans	79.4	129	178.5	-167.7	0	0	0	0	113.6
610	S	30.5	Very low	32.8	Very low	106 Å²	106	171.4 Å²	171.4	74%	0.741	84%	0.837	S	S	*	*			trans	-107	-174.1	-172.6	-49.8	0	0	0	0	110.9	M612	S610-M612 PolarHBondContact O-N 3.4Å
611	H	29.1	Very low	32.3	Very low	176 Å²	176	172.7 Å²	172.7	82%	0.815	84%	0.838	S	S	*	*			trans	-40	135.1	162.8	-57.4	-101.7	0	0	0	113.4
612	M	35.2	Very low	31.9	Very low	188 Å²	188	165.4 Å²	165.4	93%	0.926	83%	0.829	S	S	*	*			trans	-134.3	148.9	137.1	-78.7	-72.3	98.4	0	0	106.3	S610	S610-M612 PolarHBondContact O-N 3.4Å
613	G	28.7	Very low	31.9	Very low	75 Å²	75	162.8 Å²	162.8	77%	0.773	82%	0.823	S	S	*	*			trans	-143	136.8	177.8	0	0	0	0	0	109.9
614	E	35.9	Very low	31.5	Very low	199 Å²	199	162 Å²	162	93%	0.93	82%	0.82	S	S	*	*			trans	-141.8	130.5	174.1	-80.3	175.4	150.6	0	0	107.5
615	D	31.6	Very low	31.1	Very low	160 Å²	160	161.8 Å²	161.8	86%	0.856	82%	0.818	S	S	*	*			trans	-84.8	141.6	178.6	-68.2	-66.4	0	0	0	111.3
616	L	31.9	Very low	30.6	Very low	151 Å²	151	158.7 Å²	158.7	79%	0.791	81%	0.807	S	S	*	*			trans	-161.3	124.4	130.5	-137.2	59.2	0	0	0	115
617	E	32.4	Very low	30.1	Very low	146 Å²	146	154.5 Å²	154.5	68%	0.682	80%	0.802	S	S	*	*			trans	57.9	130.5	141.7	-83.4	-167.4	104.5	0	0	124.8
618	N	26.7	Very low	29.9	Very low	121 Å²	121	147.2 Å²	147.2	65%	0.647	79%	0.79	S	S	*	*				100.1	91.5	129	-75.3	-29.1	0	0	0	123.3
619	K	26.9	Very low	29.7	Very low	184 Å²	184	144.7 Å²	144.7	80%	0.8	79%	0.788	S	S	*	*				102	147.8	104.5	-162.5	175.8	-176.4	174.5	0	118.6
620	T	28.8	Very low	30	Very low	115 Å²	115	143.6 Å²	143.6	71%	0.706	78%	0.784	S	S	*	*			trans	81.4	82.8	171	-25.8	0	0	0	0	114.1
621	Q	27	Very low	29.8	Very low	182 Å²	182	146.5 Å²	146.5	85%	0.85	79%	0.79	S	S	*	*				84.4	110.5	76.4	-176.2	179.2	19.6	0	0	113.6
622	A	28	Very low	29.5	Very low	88 Å²	88	143 Å²	143	73%	0.727	78%	0.784	S	S	*	*			trans	-96.3	165.9	168.9	0	0	0	0	0	111.8
623	P	40.8	Very low	28.9	Very low	120 Å²	120	141 Å²	141	78%	0.779	78%	0.778	S	S	*	*			trans	-121.6	153.7	149.6	5.7	16.5	0	0	0	114.5
624	F	25.9	Very low	28.6	Very low	194 Å²	194	141.5 Å²	141.5	85%	0.851	77%	0.769	S	S	*	*			trans	-63.6	172.1	174.6	-53.4	-93.7	0	0	0	112.1
625	V	27.6	Very low	28.1	Very low	132 Å²	132	140.5 Å²	140.5	80%	0.8	76%	0.764	S	S	*	*				-161.7	138.5	52.6	177	0	0	0	0	106.8
626	N	24.7	Very low	27.7	Very low	133 Å²	133	138.3 Å²	138.3	71%	0.711	76%	0.761	S	S	*	*			cis	100.8	138.3	36.1	-153.8	15.4	0	0	0	113.7
627	L	26.6	Very low	27.3	Very low	145 Å²	145	138.2 Å²	138.2	76%	0.759	76%	0.762	S	S	*	*			trans	65.4	150.2	-178.5	-78.7	65.8	0	0	0	116.6
628	S	26.6	Very low	27	Very low	105 Å²	105	136.1 Å²	136.1	73%	0.734	76%	0.759	S	S	*	*			cis	-160.9	163.1	-4.4	-105.4	0	0	0	0	112.8
629	Q	29.8	Very low	27	Very low	184 Å²	184	137.7 Å²	137.7	86%	0.86	76%	0.762	S	S	*	*			trans	-78.8	167.5	158.5	-85.8	-172.9	5.9	0	0	110.4
630	P	36.5	Very low	26.9	Very low	111 Å²	111	136.5 Å²	136.5	72%	0.721	76%	0.759	S	S	*	*			cis	-158.6	-176.8	43.4	46	-23.6	0	0	0	120.6
631	L	25.2	Very low	26.7	Very low	167 Å²	167	136.3 Å²	136.3	87%	0.874	76%	0.763	S	S	*	*			trans	67.7	157	146.2	-121.1	68.4	0	0	0	123.6
632	C	21.9	Very low	26.6	Very low	103 Å²	103	138.7 Å²	138.7	70%	0.696	76%	0.764	S	S	*	*			trans	-72	159.2	-178	-41.5	0	0	0	0	112.4
633	N	22.6	Very low	26.5	Very low	146 Å²	146	139.6 Å²	139.6	78%	0.781	77%	0.765	S	S	*	*				-173.6	162.1	62.7	-116.3	-13.5	0	0	0	113.6
634	S	24.2	Very low	26	Very low	85 Å²	85	139.9 Å²	139.9	59%	0.594	77%	0.767	S	S	*	*			trans	53.7	119	144.1	-58	0	0	0	0	123.3
635	H	24.7	Very low	25.9	Very low	179 Å²	179	135.4 Å²	135.4	83%	0.829	76%	0.755	S	S	*	*			trans	39.1	128.1	141.2	-44	-66.8	0	0	0	120
636	S	23.5	Very low	25.8	Very low	113 Å²	113	138.3 Å²	138.3	79%	0.79	76%	0.758	S	S	*	*				178.3	153.1	56.2	45.8	0	0	0	0	114.2
637	N	23.1	Very low	25.8	Very low	150 Å²	150	136.2 Å²	136.2	80%	0.802	75%	0.754	S	S	*	*			trans	37.8	145.4	143.2	-153.2	19.4	0	0	0	123.9
638	T	25.4	Very low	25.8	Very low	101 Å²	101	137.3 Å²	137.3	62%	0.62	76%	0.755	S	S	*	*			trans	97.7	111	147.6	-21	0	0	0	0	121
639	Q	27	Very low	25.6	Very low	154 Å²	154	141 Å²	141	72%	0.72	76%	0.761	S	S	*	*			trans	62.6	111.9	144.5	-72	-174.6	1.6	0	0	124.9
640	Q	25.6	Very low	25.6	Very low	159 Å²	159	139.5 Å²	139.5	74%	0.743	76%	0.758	S	S	*	*				75.7	134	116.2	-68.3	-177.5	4.9	0	0	124.2
641	S	23.5	Very low	25.4	Very low	111 Å²	111	139.5 Å²	139.5	78%	0.776	76%	0.757	S	S	*	*			trans	72.2	140.3	155.1	81.2	0	0	0	0	116.6
642	R	25.2	Very low	26.1	Very low	233 Å²	233	138 Å²	138	88%	0.879	76%	0.755	S	S	*	*			cis	-135.7	153.8	22.4	-76.5	172.1	155.3	118.1	-8.7	113.1
643	S	26.1	Very low	26.6	Very low	107 Å²	107	141.2 Å²	141.2	75%	0.748	76%	0.764	S	S	*	*			trans	-96.1	149.1	141.9	51.4	0	0	0	0	110
644	P	31.2	Very low	27.5	Very low	126 Å²	126	138 Å²	138	82%	0.818	77%	0.765	S	S	*	*			trans	-119.4	177.5	136.8	35.1	-27.3	0	0	0	110.7
645	T	23.7	Very low	28	Very low	99 Å²	99	139.2 Å²	139.2	61%	0.607	77%	0.765	S	S	*	*			trans	-138.3	153.9	-157.7	-35.2	0	0	0	0	112.6
646	F	24.6	Very low	29	Very low	194 Å²	194	133.6 Å²	133.6	85%	0.851	76%	0.755	S	S	*	*			trans	74	154.5	174.7	-49.4	-71.8	0	0	0	114.7
647	S	24.8	Very low	30.1	Very low	89 Å²	89	134.9 Å²	134.9	62%	0.622	75%	0.749	S	S	*	*			cis	-146.4	174.7	12.6	-151.7	0	0	0	0	114.4
648	E	25.8	Very low	31.1	Very low	168 Å²	168	134 Å²	134	79%	0.785	74%	0.74	S	S	*	*			trans	75.1	155.3	150.6	-120	77.5	-164	0	0	122.7
649	E	23	Very low	32	Very low	183 Å²	183	135.5 Å²	135.5	86%	0.855	74%	0.743	S	S	*	*			trans	65.6	116.8	156.6	-154.1	144.5	-132.2	0	0	121.6
650	L	29.4	Very low	33.2	Very low	152 Å²	152	136.5 Å²	136.5	80%	0.796	74%	0.74	S	S	*	*			trans	-112.2	113.6	171.5	-135.4	177.2	0	0	0	107.8
651	P	33.2	Very low	34.6	Very low	110 Å²	110	133 Å²	133	71%	0.714	73%	0.73	S	S	*	*			trans	-89.8	128.4	159.2	31.2	-28.4	0	0	0	109.7	L653	P651-L653 PolarHBondContact O-N 3.5Å
652	V	38.8	Very low	36.1	Very low	136 Å²	136	131.5 Å²	131.5	82%	0.824	71%	0.713	S	S	*	*			trans	-76.9	111.9	172.2	174.1	0	0	0	0	109.3
653	L	34.1	Very low	38.1	Very low	171 Å²	171	124.6 Å²	124.6	90%	0.895	69%	0.691	S	S	*	*			trans	-143.1	130	150.7	-145.8	69.6	0	0	0	108.6	P651	P651-L653 PolarHBondContact O-N 3.5Å
654	G	41.4	Very low	40	Very low	77 Å²	77	122 Å²	122	79%	0.794	68%	0.676	S	S	*	*			trans	-88.1	144.8	-164.8	0	0	0	0	0	113.7
655	D	34.7	Very low	42.1	Very low	112 Å²	112	119.9 Å²	119.9	60%	0.599	66%	0.658	S	S	*	*			trans	-144.4	121.4	155.9	-168.9	2.4	0	0	0	110.9	Q657	D655-Q657 VanDerWaalsContact C-N 3.33Å; D655-Q657 VanDerWaalsContact OD1-CB 3.27Å; D655-Q657 WeakPolarHBondContact OD1-CB 3.48Å; D655-Q657 PolarHBondContact OD1-N 2.84Å
656	G	44.3	Very low	44.8	Very low	60 Å²	60	120.5 Å²	120.5	62%	0.619	66%	0.656	S	S	*	*	S	Bend	trans	-79.9	-14.7	175.7	0	0	0	0	0	113.5
657	Q	46.9	Very low	47.7	Very low	141 Å²	141	117.2 Å²	117.2	66%	0.659	64%	0.643	S	S	*	*	H	α-helix	trans	-71.6	-36.1	-171.3	-134.4	81.7	-35.1	0	0	112.9	D655 L659 R660 T661	D655-Q657 VanDerWaalsContact C-N 3.33Å; D655-Q657 VanDerWaalsContact OD1-CB 3.27Å; D655-Q657 WeakPolarHBondContact OD1-CB 3.48Å; D655-Q657 PolarHBondContact OD1-N 2.84Å; Q657-L659 PolarHBondContact O-N 3.3Å; Q657-R660 PolarHBondContact O-N 2.95Å; Q657-T661 PolarHBondContact O-N 2.87Å
658	Q	43.8	Very low	50.6	Low	130 Å²	130	121 Å²	121	61%	0.607	64%	0.644	S	S	*	*	H	α-helix	trans	-68.3	-31	-170.4	-89.4	-159.6	36.7	0	0	115.4	T661 N662	Q658-T661 PolarHBondContact O-OG1 3.41Å; Q658-T661 VanDerWaalsContact O-OG1 3.04Å; Q658-N662 PolarHBondContact O-N 2.89Å; Q658-N662 PolarHBondContact O-ND2 2.85Å
659	L	45.5	Very low	53.6	Low	133 Å²	133	119 Å²	119	70%	0.696	63%	0.633	S	S	*	*	H	α-helix	trans	-68.8	-40.4	-179.9	-73.2	171	0	0	0	111	Q657 T661 N662 E663	Q657-L659 PolarHBondContact O-N 3.3Å; L659-T661 PolarHBondContact O-N 3.31Å; L659-N662 PolarHBondContact O-N 2.87Å; L659-E663 WeakPolarHBondContact O-CG 3.26Å; L659-E663 PolarHBondContact O-N 3.31Å
660	R	52	Low	56.8	Low	175 Å²	175	115.5 Å²	115.5	66%	0.66	62%	0.62	S	S	*	*	H	α-helix	trans	-68.1	-35.2	-178.3	-58.6	-63.4	-71.9	159.7	-9	112.7	Q657 E663 A664	Q657-R660 PolarHBondContact O-N 2.95Å; R660-E663 WeakPolarHBondContact CD-OE2 3.44Å; R660-E663 IonicContact CZ-OE2 3.45Å; R660-E663 IonicContact NE-OE2 3.41Å; R660-E663 IonicContact NH1-OE2 3.14Å; R660-E663 PolarHBondContact NH1-OE2 2.89Å; R660-A664 WeakPolarHBondContact O-CB 3.27Å; R660-A664 PolarHBondContact O-N 3.5Å
661	T	55.2	Low	59.7	Low	85 Å²	85	113 Å²	113	52%	0.521	61%	0.606	S	S	.	*	H	α-helix	trans	-71.1	-35	175.4	55.9	0	0	0	0	112.1	Q657 Q658 L659 L665	Q657-T661 PolarHBondContact O-N 2.87Å; Q658-T661 PolarHBondContact O-OG1 3.41Å; Q658-T661 VanDerWaalsContact O-OG1 3.04Å; L659-T661 PolarHBondContact O-N 3.31Å; T661-L665 WeakPolarHBondContact O-CB 3.26Å; T661-L665 PolarHBondContact O-N 3.41Å
662	N	55	Low	62.3	Low	80 Å²	80	112.4 Å²	112.4	43%	0.428	60%	0.595	S	S	.	*	H	α-helix	trans	-70	-42.2	173.6	-80.5	-77.2	0	0	0	112.4	Q658 L659 A664 L665 I666	Q658-N662 PolarHBondContact O-N 2.89Å; Q658-N662 PolarHBondContact O-ND2 2.85Å; L659-N662 PolarHBondContact O-N 2.87Å; N662-A664 VanDerWaalsContact C-N 3.35Å; N662-A664 PolarHBondContact O-N 2.91Å; N662-L665 PolarHBondContact O-N 3.22Å; N662-I666 VanDerWaalsContact O-CG1 3.29Å; N662-I666 WeakPolarHBondContact O-CG1 3.26Å; N662-I666 PolarHBondContact O-N 2.91Å
663	E	67.1	Low	64.7	Low	88 Å²	88	108.3 Å²	108.3	41%	0.411	58%	0.575	S	S	.	*	H	α-helix	trans	-57.3	-46.7	171.5	-73.6	178.7	143.4	0	0	111.6	L659 R660 L665 I666 Q667	L659-E663 WeakPolarHBondContact O-CG 3.26Å; L659-E663 PolarHBondContact O-N 3.31Å; R660-E663 WeakPolarHBondContact CD-OE2 3.44Å; R660-E663 IonicContact CZ-OE2 3.45Å; R660-E663 IonicContact NE-OE2 3.41Å; R660-E663 IonicContact NH1-OE2 3.14Å; R660-E663 PolarHBondContact NH1-OE2 2.89Å; E663-L665 VanDerWaalsContact C-N 3.34Å; E663-L665 PolarHBondContact O-N 2.86Å; E663-I666 PolarHBondContact O-N 2.87Å; E663-Q667 WeakPolarHBondContact O-CG 3.41Å; E663-Q667 PolarHBondContact O-N 3.23Å
664	A	66.5	Low	67.4	Low	52 Å²	52	108.2 Å²	108.2	43%	0.43	56%	0.563	S	S	.	*	H	α-helix	trans	-63.8	-35.8	176.6	0	0	0	0	0	112.8	R660 N662 R668	R660-A664 WeakPolarHBondContact O-CB 3.27Å; R660-A664 PolarHBondContact O-N 3.5Å; N662-A664 VanDerWaalsContact C-N 3.35Å; N662-A664 PolarHBondContact O-N 2.91Å; A664-R668 VanDerWaalsContact O-CB 3.26Å; A664-R668 WeakPolarHBondContact O-CB 3.23Å; A664-R668 PolarHBondContact O-N 3.03Å
665	L	74.8	Confident	69.8	Low	83 Å²	83	109.1 Å²	109.1	44%	0.435	55%	0.549	S	S	.	.	H	α-helix	trans	-67.4	-38.7	174.4	-166.8	97.3	0	0	0	111.8	T661 N662 E663 K669	T661-L665 WeakPolarHBondContact O-CB 3.26Å; T661-L665 PolarHBondContact O-N 3.41Å; N662-L665 PolarHBondContact O-N 3.22Å; E663-L665 VanDerWaalsContact C-N 3.34Å; E663-L665 PolarHBondContact O-N 2.86Å; L665-K669 WeakPolarHBondContact O-CG 3.36Å; L665-K669 PolarHBondContact O-N 3.3Å
666	I	80.3	Confident	72.3	Confident	111 Å²	111	106.5 Å²	106.5	57%	0.569	54%	0.543	S	S	*	.	H	α-helix	trans	-66.8	-48.4	175.9	-68.5	163	0	0	0	110	N662 E663 R668 K669 D670	N662-I666 VanDerWaalsContact O-CG1 3.29Å; N662-I666 WeakPolarHBondContact O-CG1 3.26Å; N662-I666 PolarHBondContact O-N 2.91Å; E663-I666 PolarHBondContact O-N 2.87Å; I666-R668 VanDerWaalsContact C-N 3.33Å; I666-R668 PolarHBondContact O-N 3.41Å; I666-K669 WeakPolarHBondContact O-CB 3.29Å; I666-K669 PolarHBondContact O-N 3.37Å; I666-K669 VanDerWaalsContact O-N 3.12Å; I666-D670 PolarHBondContact O-N 3.17Å
667	Q	84.4	Confident	74.5	Confident	125 Å²	125	108.9 Å²	108.9	58%	0.584	54%	0.541	S	S	*	.	H	α-helix	trans	-59.1	-42.1	174.9	-71.9	176	-1	0	0	111.9	E663 K669 D670 I671	E663-Q667 WeakPolarHBondContact O-CG 3.41Å; E663-Q667 PolarHBondContact O-N 3.23Å; Q667-K669 VanDerWaalsContact C-N 3.34Å; Q667-K669 PolarHBondContact O-N 3.35Å; Q667-D670 PolarHBondContact O-N 3.32Å; Q667-I671 WeakPolarHBondContact O-CB 3.26Å; Q667-I671 WeakPolarHBondContact O-CD1 3.5Å; Q667-I671 VanDerWaalsContact O-CG1 3.24Å; Q667-I671 WeakPolarHBondContact O-CG1 3.25Å; Q667-I671 PolarHBondContact O-N 3.26Å
668	R	86.3	Confident	76.6	Confident	170 Å²	170	105.6 Å²	105.6	64%	0.642	53%	0.528	S	S	*	.	H	α-helix	trans	-62.9	-38.5	175.3	-174.5	177.5	175.5	-173.8	-0.3	112.1	A664 I666 M672	A664-R668 VanDerWaalsContact O-CB 3.26Å; A664-R668 WeakPolarHBondContact O-CB 3.23Å; A664-R668 PolarHBondContact O-N 3.03Å; I666-R668 VanDerWaalsContact C-N 3.33Å; I666-R668 PolarHBondContact O-N 3.41Å; R668-M672 HydrophobicContact CG-CE 4.21Å; R668-M672 HydrophobicContact CG-SD 4.43Å; R668-M672 WeakPolarHBondContact O-CB 3.41Å; R668-M672 VanDerWaalsContact O-CG 3.25Å; R668-M672 WeakPolarHBondContact O-CG 3.31Å; R668-M672 PolarHBondContact O-N 2.86Å
669	K	88.4	Confident	78.8	Confident	126 Å²	126	103.5 Å²	103.5	55%	0.548	52%	0.524	S	S	.	.	H	α-helix	trans	-66.8	-43.5	174.7	-76.4	171.8	177.3	179.4	0	111.9	L665 I666 Q667 M672 A673	L665-K669 WeakPolarHBondContact O-CG 3.36Å; L665-K669 PolarHBondContact O-N 3.3Å; I666-K669 WeakPolarHBondContact O-CB 3.29Å; I666-K669 PolarHBondContact O-N 3.37Å; I666-K669 VanDerWaalsContact O-N 3.12Å; Q667-K669 VanDerWaalsContact C-N 3.34Å; Q667-K669 PolarHBondContact O-N 3.35Å; K669-M672 HydrophobicContact CG-CE 4.4Å; K669-M672 PolarHBondContact O-N 3.19Å; K669-A673 WeakPolarHBondContact O-CB 3.37Å; K669-A673 PolarHBondContact O-N 2.97Å
670	D	89.8	Confident	80.9	Confident	109 Å²	109	103 Å²	103	58%	0.583	52%	0.521	S	S	*	.	H	α-helix	trans	-63.9	-43.9	177.7	-169.2	57.7	0	0	0	111.8	I666 Q667 M672 A673 R674	I666-D670 PolarHBondContact O-N 3.17Å; Q667-D670 PolarHBondContact O-N 3.32Å; D670-M672 PolarHBondContact O-N 3.35Å; D670-A673 PolarHBondContact O-N 2.91Å; D670-R674 WeakPolarHBondContact O-CB 3.46Å; D670-R674 PolarHBondContact O-N 3.19Å
671	I	92.2	Very high	82.8	Confident	98 Å²	98	100.5 Å²	100.5	50%	0.503	52%	0.517	S	S	.	.	H	α-helix	trans	-61	-43.7	172.9	-69.5	164.8	0	0	0	111.2	Q667 R674 I675	Q667-I671 WeakPolarHBondContact O-CB 3.26Å; Q667-I671 WeakPolarHBondContact O-CD1 3.5Å; Q667-I671 VanDerWaalsContact O-CG1 3.24Å; Q667-I671 WeakPolarHBondContact O-CG1 3.25Å; Q667-I671 PolarHBondContact O-N 3.26Å; I671-R674 PolarHBondContact O-N 2.93Å; I671-I675 HydrophobicContact CG2-CD1 3.81Å; I671-I675 HydrophobicContact CG2-CG1 4.49Å; I671-I675 WeakPolarHBondContact O-CB 3.48Å; I671-I675 VanDerWaalsContact O-CG1 3.24Å; I671-I675 WeakPolarHBondContact O-CG1 3.47Å; I671-I675 PolarHBondContact O-N 2.83Å
672	M	87.8	Confident	84.3	Confident	98 Å²	98	100.6 Å²	100.6	48%	0.483	52%	0.515	S	S	.	.	H	α-helix	trans	-66.9	-36.8	177.1	-72.5	-176.2	-49.7	0	0	112.7	R668 K669 D670 I675 A676	R668-M672 HydrophobicContact CG-CE 4.21Å; R668-M672 HydrophobicContact CG-SD 4.43Å; R668-M672 WeakPolarHBondContact O-CB 3.41Å; R668-M672 VanDerWaalsContact O-CG 3.25Å; R668-M672 WeakPolarHBondContact O-CG 3.31Å; R668-M672 PolarHBondContact O-N 2.86Å; K669-M672 HydrophobicContact CG-CE 4.4Å; K669-M672 PolarHBondContact O-N 3.19Å; D670-M672 PolarHBondContact O-N 3.35Å; M672-I675 PolarHBondContact O-N 3.16Å; M672-A676 PolarHBondContact O-N 2.94Å
673	A	87.6	Confident	85.7	Confident	50 Å²	50	100.3 Å²	100.3	41%	0.413	52%	0.519	S	S	.	.	H	α-helix	trans	-63.6	-46.7	172.3	0	0	0	0	0	111	K669 D670 I675 A676 D677	K669-A673 WeakPolarHBondContact O-CB 3.37Å; K669-A673 PolarHBondContact O-N 2.97Å; D670-A673 PolarHBondContact O-N 2.91Å; A673-I675 VanDerWaalsContact C-N 3.29Å; A673-I675 PolarHBondContact O-N 2.87Å; A673-A676 WeakPolarHBondContact O-CB 3.35Å; A673-A676 PolarHBondContact O-N 2.88Å; A673-D677 PolarHBondContact O-N 2.88Å
674	R	90.9	Very high	86.3	Confident	169 Å²	169	98.2 Å²	98.2	64%	0.638	52%	0.517	S	S	*	.	H	α-helix	trans	-62.9	-33.4	177.1	-164.3	172.1	-168.2	-94.7	-1.2	113	D670 I671 L678	D670-R674 WeakPolarHBondContact O-CB 3.46Å; D670-R674 PolarHBondContact O-N 3.19Å; I671-R674 PolarHBondContact O-N 2.93Å; R674-L678 HydrophobicContact CG-CD1 4.49Å; R674-L678 WeakPolarHBondContact O-CB 3.42Å; R674-L678 WeakPolarHBondContact O-CD1 3.47Å; R674-L678 WeakPolarHBondContact O-CG 3.03Å; R674-L678 PolarHBondContact O-N 3.09Å
675	I	91.9	Very high	87.1	Confident	96 Å²	96	100.8 Å²	100.8	49%	0.492	52%	0.521	S	S	.	.	H	α-helix	trans	-67.6	-44.4	171	-71.8	164.7	0	0	0	110.5	I671 M672 A673 L678 T679	I671-I675 HydrophobicContact CG2-CD1 3.81Å; I671-I675 HydrophobicContact CG2-CG1 4.49Å; I671-I675 WeakPolarHBondContact O-CB 3.48Å; I671-I675 VanDerWaalsContact O-CG1 3.24Å; I671-I675 WeakPolarHBondContact O-CG1 3.47Å; I671-I675 PolarHBondContact O-N 2.83Å; M672-I675 PolarHBondContact O-N 3.16Å; A673-I675 VanDerWaalsContact C-N 3.29Å; A673-I675 PolarHBondContact O-N 2.87Å; I675-L678 PolarHBondContact O-N 3.5Å; I675-T679 WeakPolarHBondContact O-CB 3.34Å; I675-T679 PolarHBondContact O-N 2.9Å; I675-T679 PolarHBondContact O-OG1 3.3Å
676	A	87.2	Confident	87.4	Confident	58 Å²	58	103.4 Å²	103.4	48%	0.479	53%	0.529	S	S	.	.	H	α-helix	trans	-62.2	-43.3	177.1	0	0	0	0	0	112.2	M672 A673 T679 L680	M672-A676 PolarHBondContact O-N 2.94Å; A673-A676 WeakPolarHBondContact O-CB 3.35Å; A673-A676 PolarHBondContact O-N 2.88Å; A676-T679 PolarHBondContact O-N 2.84Å; A676-L680 WeakPolarHBondContact O-CB 3.39Å; A676-L680 PolarHBondContact O-N 3.18Å
677	D	89.9	Confident	87	Confident	109 Å²	109	100.5 Å²	100.5	58%	0.583	52%	0.522	S	S	*	.	H	α-helix	trans	-63	-43	174.9	-73.4	-18.1	0	0	0	111.8	A673 L680 Q681	A673-D677 PolarHBondContact O-N 2.88Å; D677-L680 PolarHBondContact O-N 3.41Å; D677-Q681 VanDerWaalsContact O-CB 3.3Å; D677-Q681 WeakPolarHBondContact O-CB 3.42Å; D677-Q681 PolarHBondContact O-N 3.3Å
678	L	92.9	Very high	86	Confident	72 Å²	72	100.9 Å²	100.9	38%	0.377	52%	0.523	S	S	.	.	H	α-helix	trans	-64.5	-37.3	173.5	-84.8	163.5	0	0	0	112.3	R674 I675 Q681 N682	R674-L678 HydrophobicContact CG-CD1 4.49Å; R674-L678 WeakPolarHBondContact O-CB 3.42Å; R674-L678 WeakPolarHBondContact O-CD1 3.47Å; R674-L678 WeakPolarHBondContact O-CG 3.03Å; R674-L678 PolarHBondContact O-N 3.09Å; I675-L678 PolarHBondContact O-N 3.5Å; L678-Q681 PolarHBondContact O-N 2.93Å; L678-N682 VanDerWaalsContact O-CB 3.23Å; L678-N682 WeakPolarHBondContact O-CB 3.35Å; L678-N682 PolarHBondContact O-N 3.01Å; L678-N682 PolarHBondContact O-ND2 3.45Å
679	T	89.8	Confident	84.9	Confident	87 Å²	87	96.7 Å²	96.7	53%	0.534	52%	0.517	S	S	.	.	H	α-helix	trans	-67.1	-40.9	174.6	-64.6	0	0	0	0	111.3	I675 A676 S683	I675-T679 WeakPolarHBondContact O-CB 3.34Å; I675-T679 PolarHBondContact O-N 2.9Å; I675-T679 PolarHBondContact O-OG1 3.3Å; A676-T679 PolarHBondContact O-N 2.84Å; T679-S683 VanDerWaalsContact O-CB 3.26Å; T679-S683 WeakPolarHBondContact O-CB 3.44Å; T679-S683 PolarHBondContact O-N 2.94Å
680	L	89.4	Confident	83.4	Confident	122 Å²	122	95.2 Å²	95.2	64%	0.639	52%	0.515	S	S	*	.	H	α-helix	trans	-64.6	-43.5	174.2	-178	62	0	0	0	111.4	A676 D677 S683 A684	A676-L680 WeakPolarHBondContact O-CB 3.39Å; A676-L680 PolarHBondContact O-N 3.18Å; D677-L680 PolarHBondContact O-N 3.41Å; L680-S683 WeakPolarHBondContact O-CB 3.44Å; L680-S683 PolarHBondContact O-N 2.84Å; L680-A684 WeakPolarHBondContact O-CB 3.44Å; L680-A684 PolarHBondContact O-N 3.31Å
681	Q	91.9	Very high	81.4	Confident	122 Å²	122	94.9 Å²	94.9	57%	0.57	52%	0.521	S	S	*	.	H	α-helix	trans	-66	-42.9	177.2	-174.8	169.5	70.3	0	0	112.1	D677 L678 S683 A684 M685	D677-Q681 VanDerWaalsContact O-CB 3.3Å; D677-Q681 WeakPolarHBondContact O-CB 3.42Å; D677-Q681 PolarHBondContact O-N 3.3Å; L678-Q681 PolarHBondContact O-N 2.93Å; Q681-S683 VanDerWaalsContact C-N 3.33Å; Q681-S683 PolarHBondContact O-N 2.75Å; Q681-A684 PolarHBondContact O-N 3.24Å; Q681-M685 WeakPolarHBondContact O-CG 3.37Å; Q681-M685 PolarHBondContact O-N 3.44Å
682	N	85.4	Confident	79.5	Confident	87 Å²	87	97 Å²	97	47%	0.465	53%	0.532	S	S	.	.	H	α-helix	trans	-64.3	-37.3	173.2	-74.6	-26.9	0	0	0	111.9	L678 M685 K686	L678-N682 VanDerWaalsContact O-CB 3.23Å; L678-N682 WeakPolarHBondContact O-CB 3.35Å; L678-N682 PolarHBondContact O-N 3.01Å; L678-N682 PolarHBondContact O-ND2 3.45Å; N682-M685 WeakPolarHBondContact OD1-CE 3.28Å; N682-K686 VanDerWaalsContact O-CB 3.25Å; N682-K686 WeakPolarHBondContact O-CB 3.37Å; N682-K686 PolarHBondContact O-N 3.03Å
683	S	84.3	Confident	77.5	Confident	75 Å²	75	98.6 Å²	98.6	52%	0.524	54%	0.541	S	S	.	.	H	α-helix	trans	-65.3	-42.1	173.9	-166.9	0	0	0	0	111.6	T679 L680 Q681 K686 A687	T679-S683 VanDerWaalsContact O-CB 3.26Å; T679-S683 WeakPolarHBondContact O-CB 3.44Å; T679-S683 PolarHBondContact O-N 2.94Å; L680-S683 WeakPolarHBondContact O-CB 3.44Å; L680-S683 PolarHBondContact O-N 2.84Å; Q681-S683 VanDerWaalsContact C-N 3.33Å; Q681-S683 PolarHBondContact O-N 2.75Å; S683-K686 PolarHBondContact O-N 2.83Å; S683-A687 WeakPolarHBondContact O-CB 3.35Å; S683-A687 PolarHBondContact O-N 2.85Å
684	A	81.2	Confident	75	Confident	44 Å²	44	103 Å²	103	36%	0.364	55%	0.553	S	S	.	*	H	α-helix	trans	-64.1	-46.2	174.5	0	0	0	0	0	112	L680 Q681 K686 A687 H688	L680-A684 WeakPolarHBondContact O-CB 3.44Å; L680-A684 PolarHBondContact O-N 3.31Å; Q681-A684 PolarHBondContact O-N 3.24Å; A684-K686 VanDerWaalsContact C-N 3.31Å; A684-K686 PolarHBondContact O-N 3.36Å; A684-A687 WeakPolarHBondContact O-CB 3.42Å; A684-A687 PolarHBondContact O-N 3.46Å; A684-H688 PolarHBondContact O-CD2 3.02Å; A684-H688 PolarHBondContact O-N 3.15Å
685	M	81.9	Confident	73	Confident	105 Å²	105	101.1 Å²	101.1	52%	0.517	56%	0.562	S	S	.	*	H	α-helix	trans	-58.8	-42.7	173.3	-70.2	-165.7	-56.9	0	0	111.6	Q681 N682 H688 T689	Q681-M685 WeakPolarHBondContact O-CG 3.37Å; Q681-M685 PolarHBondContact O-N 3.44Å; N682-M685 WeakPolarHBondContact OD1-CE 3.28Å; M685-H688 PolarHBondContact O-N 3.46Å; M685-T689 PolarHBondContact O-N 2.91Å; M685-T689 PolarHBondContact O-OG1 2.93Å
686	K	82.9	Confident	70.3	Confident	139 Å²	139	107 Å²	107	60%	0.604	58%	0.578	S	S	*	*	H	α-helix	trans	-67.2	-34.6	177.6	-168.1	172.6	-176.4	178	0	112.6	N682 S683 A684 T689 N690	N682-K686 VanDerWaalsContact O-CB 3.25Å; N682-K686 WeakPolarHBondContact O-CB 3.37Å; N682-K686 PolarHBondContact O-N 3.03Å; S683-K686 PolarHBondContact O-N 2.83Å; A684-K686 VanDerWaalsContact C-N 3.31Å; A684-K686 PolarHBondContact O-N 3.36Å; K686-T689 WeakPolarHBondContact CA-OG1 3.49Å; K686-T689 PolarHBondContact O-OG1 3.32Å; K686-N690 VanDerWaalsContact O-CB 3.28Å; K686-N690 WeakPolarHBondContact O-CB 3.45Å; K686-N690 PolarHBondContact O-N 3.08Å; K686-N690 PolarHBondContact O-OD1 3.22Å; K686-N690 VanDerWaalsContact O-OD1 3.08Å
687	A	70.1	Confident	67.8	Low	50 Å²	50	107.5 Å²	107.5	41%	0.413	59%	0.589	S	S	.	*	H	α-helix	trans	-64.6	-44.6	170.7	0	0	0	0	0	110.8	S683 A684 T689 N690 S691	S683-A687 WeakPolarHBondContact O-CB 3.35Å; S683-A687 PolarHBondContact O-N 2.85Å; A684-A687 WeakPolarHBondContact O-CB 3.42Å; A684-A687 PolarHBondContact O-N 3.46Å; A687-T689 PolarHBondContact O-N 3.36Å; A687-N690 PolarHBondContact O-N 2.97Å; A687-S691 PolarHBondContact O-N 2.96Å; A687-S691 PolarHBondContact O-OG 3.35Å
688	H	64.9	Low	65	Low	132 Å²	132	111.9 Å²	111.9	61%	0.611	61%	0.606	S	S	*	*	H	α-helix	trans	-63.9	-38.4	176.3	-66.5	-49.7	0	0	0	113.2	A684 M685 I692	A684-H688 PolarHBondContact O-CD2 3.02Å; A684-H688 PolarHBondContact O-N 3.15Å; M685-H688 PolarHBondContact O-N 3.46Å; H688-I692 WeakPolarHBondContact O-CD1 3.32Å; H688-I692 WeakPolarHBondContact O-CG1 3.39Å
689	T	62.8	Low	62.2	Low	83 Å²	83	118.1 Å²	118.1	51%	0.509	63%	0.634	S	S	.	*	H	α-helix	trans	-68.3	-36.9	172.8	54.4	0	0	0	0	112.2	M685 K686 A687 I692	M685-T689 PolarHBondContact O-N 2.91Å; M685-T689 PolarHBondContact O-OG1 2.93Å; K686-T689 WeakPolarHBondContact CA-OG1 3.49Å; K686-T689 PolarHBondContact O-OG1 3.32Å; A687-T689 PolarHBondContact O-N 3.36Å; T689-I692 PolarHBondContact O-N 2.9Å
690	N	56.9	Low	59.3	Low	95 Å²	95	117.6 Å²	117.6	51%	0.508	65%	0.646	S	S	.	*	H	α-helix	trans	-71.7	-34.6	179.1	-71.9	14.1	0	0	0	112.1	K686 A687 I692 I693	K686-N690 VanDerWaalsContact O-CB 3.28Å; K686-N690 WeakPolarHBondContact O-CB 3.45Å; K686-N690 PolarHBondContact O-N 3.08Å; K686-N690 PolarHBondContact O-OD1 3.22Å; K686-N690 VanDerWaalsContact O-OD1 3.08Å; A687-N690 PolarHBondContact O-N 2.97Å; N690-I692 PolarHBondContact O-N 2.82Å; N690-I693 PolarHBondContact O-N 3.27Å; N690-I693 VanDerWaalsContact O-N 3.09Å
691	S	47.4	Very low	56.5	Low	101 Å²	101	119.4 Å²	119.4	71%	0.706	66%	0.656	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.2	-8.3	174.4	-68.2	0	0	0	0	114.6	A687 I693	A687-S691 PolarHBondContact O-N 2.96Å; A687-S691 PolarHBondContact O-OG 3.35Å; S691-I693 VanDerWaalsContact C-N 3.29Å
692	I	51.3	Low	53.4	Low	144 Å²	144	116.9 Å²	116.9	74%	0.738	66%	0.662	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.1	-6	171.9	-67.3	165	0	0	0	111	H688 T689 N690	H688-I692 WeakPolarHBondContact O-CD1 3.32Å; H688-I692 WeakPolarHBondContact O-CG1 3.39Å; T689-I692 PolarHBondContact O-N 2.9Å; N690-I692 PolarHBondContact O-N 2.82Å
693	I	47.7	Very low	50.6	Low	130 Å²	130	121.7 Å²	121.7	67%	0.667	68%	0.679	S	S	*	*	S	Bend	trans	-116.4	93.8	175.1	-52.7	177.4	0	0	0	108.1	N690 S691	N690-I693 PolarHBondContact O-N 3.27Å; N690-I693 VanDerWaalsContact O-N 3.09Å; S691-I693 VanDerWaalsContact C-N 3.29Å
694	E	34.8	Very low	48	Very low	143 Å²	143	127.4 Å²	127.4	67%	0.668	69%	0.69	S	S	*	*			trans	-57.8	149.6	173.3	-86.5	-160.8	137.6	0	0	111.7
695	P	48.1	Very low	45.4	Very low	129 Å²	129	132 Å²	132	84%	0.838	70%	0.703	S	S	*	*				-115.3	129.5	103.8	-9.2	27.3	0	0	0	114.1	G697	P695-G697 PolarHBondContact O-N 2.87Å; P695-G697 VanDerWaalsContact O-N 3.13Å
696	R	36.2	Very low	43	Very low	219 Å²	219	135.2 Å²	135.2	83%	0.826	72%	0.722	S	S	*	*			trans	-71.9	90	176.7	-173.1	-179.6	-168.5	-112.9	6.9	112.9
697	G	34.9	Very low	40.2	Very low	69 Å²	69	134 Å²	134	71%	0.711	72%	0.722	S	S	*	*			trans	71.9	124.2	148.7	0	0	0	0	0	119.8	P695	P695-G697 PolarHBondContact O-N 2.87Å; P695-G697 VanDerWaalsContact O-N 3.13Å
698	E	30.7	Very low	38.6	Very low	201 Å²	201	139.5 Å²	139.5	94%	0.939	74%	0.737	S	S	*	*			trans	-133.9	124	150.1	-80.2	-161.9	147	0	0	110.6
699	Q	33.9	Very low	37	Very low	204 Å²	204	138.9 Å²	138.9	95%	0.953	73%	0.734	S	S	*	*			trans	-155.6	91.3	156.2	-175.7	169.6	47.7	0	0	108.1
700	G	29.4	Very low	35.3	Very low	76 Å²	76	142.8 Å²	142.8	78%	0.784	75%	0.746	S	S	*	*			trans	176.7	103.6	-177.7	0	0	0	0	0	112.9
701	D	29	Very low	33.8	Very low	159 Å²	159	143.5 Å²	143.5	85%	0.85	76%	0.759	S	S	*	*			trans	-57.6	145.2	168.2	174.8	28.8	0	0	0	111.9
702	G	26.6	Very low	32.8	Very low	69 Å²	69	142.5 Å²	142.5	71%	0.711	76%	0.757	S	S	*	*			trans	166.5	92.7	-179.6	0	0	0	0	0	116
703	F	27.9	Very low	31.7	Very low	188 Å²	188	140.6 Å²	140.6	83%	0.825	76%	0.756	S	S	*	*			trans	-68.3	148.9	167.8	-74.6	-109.8	0	0	0	112.3
704	R	30	Very low	30.7	Very low	195 Å²	195	141.1 Å²	141.1	74%	0.736	76%	0.76	S	S	*	*				146.9	137.5	112.4	-173	170.6	-69.3	-92.3	4.1	115.7
705	E	26.2	Very low	30.4	Very low	140 Å²	140	140.9 Å²	140.9	65%	0.654	76%	0.761	S	S	*	*			trans	42.6	117.8	158.3	-71	141.2	-144.1	0	0	122.2
706	L	31	Very low	29.6	Very low	173 Å²	173	140.1 Å²	140.1	91%	0.906	75%	0.754	S	S	*	*			trans	-94	129.7	148.2	177	150.4	0	0	0	108.8
707	N	24.5	Very low	29.3	Very low	115 Å²	115	135.6 Å²	135.6	62%	0.615	76%	0.756	S	S	*	*			trans	-156.7	113.2	-178.6	-149.5	4.5	0	0	0	114
708	K	35.7	Very low	28.9	Very low	165 Å²	165	137.1 Å²	137.1	72%	0.717	75%	0.752	S	S	*	*			trans	57	151.3	142.8	-73.8	179	178.2	-87.2	0	121
709	Q	31.6	Very low	28.8	Very low	118 Å²	118	136.4 Å²	136.4	55%	0.551	75%	0.746	S	S	*	*			cis	-176.9	157.1	-9.3	167.3	173	-49.1	0	0	110.5
710	E	26.7	Very low	28.9	Very low	165 Å²	165	132.5 Å²	132.5	77%	0.771	74%	0.738	S	S	*	*			trans	66.8	152.9	162.7	-87.7	166	138.8	0	0	118.8
711	S	25.3	Very low	28.8	Very low	110 Å²	110	136.2 Å²	136.2	77%	0.769	74%	0.738	S	S	*	*			cis	-154.1	177.6	-4.2	60.8	0	0	0	0	109
712	A	27.5	Very low	28.9	Very low	80 Å²	80	133.6 Å²	133.6	66%	0.661	74%	0.739	S	S	*	*			cis	-154.8	161.5	8	0	0	0	0	0	112
713	S	28.4	Very low	29.2	Very low	104 Å²	104	138.5 Å²	138.5	73%	0.727	74%	0.743	S	S	*	*			trans	29.5	123.1	156.3	58.1	0	0	0	0	121.4
714	D	25.2	Very low	29.8	Very low	141 Å²	141	135.3 Å²	135.3	75%	0.754	74%	0.744	S	S	*	*				61.6	136.9	66.4	-82.4	-29.5	0	0	0	115.5
715	M	29.7	Very low	30.2	Very low	139 Å²	139	133.1 Å²	133.1	69%	0.685	75%	0.746	S	S	*	*			cis	-147.3	145.9	24.3	-118.6	-55.3	156.9	0	0	114.4
716	T	30.5	Very low	31.1	Very low	113 Å²	113	130.3 Å²	130.3	69%	0.693	75%	0.747	S	S	*	*			trans	36.6	138	154.7	45.2	0	0	0	0	122.3
717	S	30.2	Very low	31.6	Very low	123 Å²	123	128 Å²	128	86%	0.86	74%	0.742	S	S	*	*				-152.3	-179.5	51.6	54.9	0	0	0	0	114.4
718	T	26	Very low	33.1	Very low	102 Å²	102	123.9 Å²	123.9	63%	0.626	73%	0.727	S	S	*	*			trans	-120.9	167.2	-144.5	-40.3	0	0	0	0	114.8
719	F	29.1	Very low	34.9	Very low	186 Å²	186	119.5 Å²	119.5	82%	0.816	72%	0.717	S	S	*	*			trans	104.1	143.5	162.8	-60.4	-62.1	0	0	0	116.6
720	P	35.6	Very low	36.9	Very low	121 Å²	121	121.1 Å²	121.1	79%	0.786	73%	0.727	S	S	*	*				-118.4	154.2	-108.5	40.1	-34.6	0	0	0	115.5
721	I	27.5	Very low	39.7	Very low	154 Å²	154	119.7 Å²	119.7	79%	0.79	72%	0.72	S	S	*	*			trans	-98.6	127.6	173	-68.5	171.4	0	0	0	109.3	Q723	I721-Q723 PolarHBondContact O-N 3.49Å
722	A	32.8	Very low	42.7	Very low	104 Å²	104	120 Å²	120	86%	0.86	71%	0.709	S	S	*	*			trans	-69.6	113.1	170.4	0	0	0	0	0	109.5
723	Q	32.8	Very low	45.7	Very low	172 Å²	172	124.8 Å²	124.8	80%	0.804	71%	0.71	S	S	*	*			trans	-80.9	128.4	177.1	-67.1	179.5	-11.1	0	0	110.1	I721	I721-Q723 PolarHBondContact O-N 3.49Å
724	S	40.4	Very low	48.7	Very low	121 Å²	121	123.2 Å²	123.2	85%	0.846	69%	0.693	S	S	*	*			trans	-71.5	127.4	163.7	53.8	0	0	0	0	109.4
725	L	38.5	Very low	51.9	Low	150 Å²	150	119.3 Å²	119.3	79%	0.785	68%	0.681	S	S	*	*			trans	-139.9	115.9	-178.3	-166.7	72.5	0	0	0	112.4
726	A	43.5	Very low	54.9	Low	81 Å²	81	115.9 Å²	115.9	67%	0.669	66%	0.663	S	S	*	*			trans	59.3	161.8	156.8	0	0	0	0	0	119.1	G728	A726-G728 VanDerWaalsContact C-N 3.32Å; A726-G728 PolarHBondContact O-N 3.26Å
727	P	43.1	Very low	57.9	Low	124 Å²	124	115.9 Å²	115.9	81%	0.805	66%	0.658	S	S	*	*			trans	-71.4	90.6	163.3	30.1	-34	0	0	0	109.5
728	G	55.5	Low	60.8	Low	28 Å²	28	114.8 Å²	114.8	29%	0.289	64%	0.642	S	S	.	*			trans	-52.7	153.6	174.6	0	0	0	0	0	113.1	A726 E732	A726-G728 VanDerWaalsContact C-N 3.32Å; A726-G728 PolarHBondContact O-N 3.26Å; G728-E732 WeakPolarHBondContact CA-OE2 3.35Å
729	S	72.9	Confident	64.2	Low	74 Å²	74	115 Å²	115	52%	0.517	63%	0.632	S	S	.	*			trans	-53.8	155.2	-176.8	179	0	0	0	0	111.8	E731 E732 R733	S729-E731 PolarHBondContact O-N 3.19Å; S729-E731 VanDerWaalsContact O-N 3.15Å; S729-E731 PolarHBondContact OG-N 3.41Å; S729-E732 PolarHBondContact N-OE2 2.71Å; S729-E732 VanDerWaalsContact N-OE2 3.16Å; S729-E732 WeakPolarHBondContact O-CA 3.08Å; S729-E732 WeakPolarHBondContact O-CB 3.19Å; S729-E732 PolarHBondContact O-N 3.16Å; S729-R733 PolarHBondContact O-N 2.81Å
730	M	74.4	Confident	67.4	Low	151 Å²	151	110.8 Å²	110.8	74%	0.744	62%	0.615	S	S	*	*	H	α-helix	trans	-55.2	-34.8	173.6	-173	168.4	-175.5	0	0	111.5	R733 I734	M730-R733 PolarHBondContact O-N 3.31Å; M730-I734 HydrophobicContact CG-CD1 4.26Å; M730-I734 WeakPolarHBondContact O-CD1 3.28Å; M730-I734 VanDerWaalsContact O-CG1 3.26Å; M730-I734 WeakPolarHBondContact O-CG1 3.39Å; M730-I734 PolarHBondContact O-N 3.27Å
731	E	84.4	Confident	70.2	Confident	135 Å²	135	107.2 Å²	107.2	63%	0.631	59%	0.592	S	S	*	*	H	α-helix	trans	-66	-38.7	174.3	-159.8	62.4	-153.9	0	0	112.6	S729 I734 A735	S729-E731 PolarHBondContact O-N 3.19Å; S729-E731 VanDerWaalsContact O-N 3.15Å; S729-E731 PolarHBondContact OG-N 3.41Å; E731-I734 WeakPolarHBondContact O-CB 3.44Å; E731-I734 PolarHBondContact O-N 2.9Å; E731-A735 WeakPolarHBondContact O-CB 3.43Å; E731-A735 PolarHBondContact O-N 2.94Å
732	E	87.9	Confident	73.3	Confident	117 Å²	117	106 Å²	106	55%	0.547	59%	0.585	S	S	.	*	H	α-helix	trans	-69.4	-38.5	177.2	-171.9	175.4	-170.6	0	0	111.2	G728 S729 I734 A735 E736	G728-E732 WeakPolarHBondContact CA-OE2 3.35Å; S729-E732 PolarHBondContact N-OE2 2.71Å; S729-E732 VanDerWaalsContact N-OE2 3.16Å; S729-E732 WeakPolarHBondContact O-CA 3.08Å; S729-E732 WeakPolarHBondContact O-CB 3.19Å; S729-E732 PolarHBondContact O-N 3.16Å; E732-I734 VanDerWaalsContact C-N 3.31Å; E732-I734 PolarHBondContact O-N 3.13Å; E732-A735 PolarHBondContact O-N 2.83Å; E732-E736 VanDerWaalsContact O-CB 3.28Å; E732-E736 WeakPolarHBondContact O-CB 3.39Å; E732-E736 PolarHBondContact O-N 3.32Å
733	R	91.5	Very high	76.3	Confident	180 Å²	180	104.7 Å²	104.7	68%	0.679	56%	0.561	S	S	*	*	H	α-helix	trans	-62.6	-37.2	170.4	-169.2	-175.4	-60	-174.9	1.6	112	S729 M730 L737	S729-R733 PolarHBondContact O-N 2.81Å; M730-R733 PolarHBondContact O-N 3.31Å; R733-L737 VanDerWaalsContact O-CB 3.27Å; R733-L737 WeakPolarHBondContact O-CB 3.23Å; R733-L737 PolarHBondContact O-N 2.87Å
734	I	92	Very high	79.2	Confident	71 Å²	71	99.2 Å²	99.2	36%	0.364	55%	0.545	S	S	.	.	H	α-helix	trans	-69.2	-43.3	175	-70.7	162.6	0	0	0	110.6	M730 E731 E732 L737 N738	M730-I734 HydrophobicContact CG-CD1 4.26Å; M730-I734 WeakPolarHBondContact O-CD1 3.28Å; M730-I734 VanDerWaalsContact O-CG1 3.26Å; M730-I734 WeakPolarHBondContact O-CG1 3.39Å; M730-I734 PolarHBondContact O-N 3.27Å; E731-I734 WeakPolarHBondContact O-CB 3.44Å; E731-I734 PolarHBondContact O-N 2.9Å; E732-I734 VanDerWaalsContact C-N 3.31Å; E732-I734 PolarHBondContact O-N 3.13Å; I734-L737 PolarHBondContact O-N 3.4Å; I734-N738 WeakPolarHBondContact O-CB 3.4Å; I734-N738 PolarHBondContact O-N 2.93Å; I734-N738 PolarHBondContact O-ND2 2.94Å
735	A	91.4	Very high	81.7	Confident	60 Å²	60	101.7 Å²	101.7	50%	0.496	54%	0.536	S	S	.	.	H	α-helix	trans	-61.7	-44.7	175.4	0	0	0	0	0	112	E731 E732 N738 R739	E731-A735 WeakPolarHBondContact O-CB 3.43Å; E731-A735 PolarHBondContact O-N 2.94Å; E732-A735 PolarHBondContact O-N 2.83Å; A735-N738 PolarHBondContact O-N 3.03Å; A735-R739 PolarHBondContact O-N 2.71Å
736	E	92.4	Very high	84.4	Confident	67 Å²	67	96.3 Å²	96.3	31%	0.313	52%	0.517	S	S	.	.	H	α-helix	trans	-65	-43.4	176.6	174.2	55.9	-164.2	0	0	112.1	E732 N738 R739 Q740	E732-E736 VanDerWaalsContact O-CB 3.28Å; E732-E736 WeakPolarHBondContact O-CB 3.39Å; E732-E736 PolarHBondContact O-N 3.32Å; E736-N738 VanDerWaalsContact C-N 3.3Å; E736-N738 PolarHBondContact O-N 3.18Å; E736-R739 WeakPolarHBondContact O-CB 3.25Å; E736-R739 PolarHBondContact O-N 2.74Å; E736-R739 IonicContact OE1-CZ 3.87Å; E736-R739 IonicContact OE1-NE 2.64Å; E736-R739 IonicContact OE1-NH2 2.74Å; E736-R739 PolarHBondContact OE1-NH2 3.17Å; E736-R739 IonicContact OE2-CZ 3.7Å; E736-R739 VanDerWaalsContact OE2-CZ 3.26Å; E736-R739 IonicContact OE2-NE 2.76Å; E736-R739 PolarHBondContact OE2-NE 3.16Å; E736-R739 IonicContact OE2-NH2 3.83Å; E736-R739 PolarHBondContact OE2-NH2 2.99Å; E736-Q740 WeakPolarHBondContact O-CG 3.49Å; E736-Q740 PolarHBondContact O-N 3.31Å; E736-Q740 PolarHBondContact OE1-NE2 3.49Å
737	L	93.9	Very high	86.8	Confident	112 Å²	112	98.2 Å²	98.2	59%	0.586	51%	0.51	S	S	*	.	H	α-helix	trans	-62.9	-37.6	174.3	-175.8	65	0	0	0	111.7	R733 I734 Q740 S741	R733-L737 VanDerWaalsContact O-CB 3.27Å; R733-L737 WeakPolarHBondContact O-CB 3.23Å; R733-L737 PolarHBondContact O-N 2.87Å; I734-L737 PolarHBondContact O-N 3.4Å; L737-Q740 PolarHBondContact O-N 2.66Å; L737-S741 VanDerWaalsContact O-CB 3.26Å; L737-S741 WeakPolarHBondContact O-CB 3.42Å; L737-S741 PolarHBondContact O-N 3.11Å
738	N	91.9	Very high	89.3	Confident	100 Å²	100	97.1 Å²	97.1	54%	0.535	50%	0.497	S	S	.	.	H	α-helix	trans	-66.7	-39	173.7	-78.4	-43.6	0	0	0	112.1	I734 A735 E736 S741 M742	I734-N738 WeakPolarHBondContact O-CB 3.4Å; I734-N738 PolarHBondContact O-N 2.93Å; I734-N738 PolarHBondContact O-ND2 2.94Å; A735-N738 PolarHBondContact O-N 3.03Å; E736-N738 VanDerWaalsContact C-N 3.3Å; E736-N738 PolarHBondContact O-N 3.18Å; N738-S741 PolarHBondContact O-N 3.37Å; N738-M742 WeakPolarHBondContact O-CB 3.23Å; N738-M742 PolarHBondContact O-N 3.18Å
739	R	96.7	Very high	91.1	Very high	107 Å²	107	101.4 Å²	101.4	40%	0.404	51%	0.513	S	S	.	.	H	α-helix	trans	-60.4	-50.5	172.1	-174.3	-175.8	69	93.2	-7.7	111.1	A735 E736 S741 M742 E743	A735-R739 PolarHBondContact O-N 2.71Å; E736-R739 WeakPolarHBondContact O-CB 3.25Å; E736-R739 PolarHBondContact O-N 2.74Å; E736-R739 IonicContact OE1-CZ 3.87Å; E736-R739 IonicContact OE1-NE 2.64Å; E736-R739 IonicContact OE1-NH2 2.74Å; E736-R739 PolarHBondContact OE1-NH2 3.17Å; E736-R739 IonicContact OE2-CZ 3.7Å; E736-R739 VanDerWaalsContact OE2-CZ 3.26Å; E736-R739 IonicContact OE2-NE 2.76Å; E736-R739 PolarHBondContact OE2-NE 3.16Å; E736-R739 IonicContact OE2-NH2 3.83Å; E736-R739 PolarHBondContact OE2-NH2 2.99Å; R739-S741 VanDerWaalsContact C-N 3.32Å; R739-S741 PolarHBondContact O-N 3.4Å; R739-M742 WeakPolarHBondContact O-CB 3.4Å; R739-M742 PolarHBondContact O-N 3.44Å; R739-E743 IonicContact CZ-OE1 2.74Å; R739-E743 IonicContact NH1-OE1 3.79Å; R739-E743 PolarHBondContact NH1-OE1 3.04Å; R739-E743 IonicContact NH1-OE2 2.94Å; R739-E743 PolarHBondContact O-N 3.09Å
740	Q	95.7	Very high	92	Very high	98 Å²	98	103.2 Å²	103.2	46%	0.458	51%	0.513	S	S	.	.	H	α-helix	trans	-60.8	-39.6	177.3	-68.4	179.9	16.7	0	0	112.2	E736 L737 E743 A744	E736-Q740 WeakPolarHBondContact O-CG 3.49Å; E736-Q740 PolarHBondContact O-N 3.31Å; E736-Q740 PolarHBondContact OE1-NE2 3.49Å; L737-Q740 PolarHBondContact O-N 2.66Å; Q740-E743 PolarHBondContact O-N 3.44Å; Q740-A744 WeakPolarHBondContact O-CB 3.48Å; Q740-A744 PolarHBondContact O-N 3.49Å
741	S	94.8	Very high	92.9	Very high	45 Å²	45	100.9 Å²	100.9	32%	0.315	50%	0.503	S	S	.	.	H	α-helix	trans	-63.9	-40.7	175.2	-172.5	0	0	0	0	112.3	L737 N738 R739 R745	L737-S741 VanDerWaalsContact O-CB 3.26Å; L737-S741 WeakPolarHBondContact O-CB 3.42Å; L737-S741 PolarHBondContact O-N 3.11Å; N738-S741 PolarHBondContact O-N 3.37Å; R739-S741 VanDerWaalsContact C-N 3.32Å; R739-S741 PolarHBondContact O-N 3.4Å; S741-R745 WeakPolarHBondContact O-CD 3.44Å; S741-R745 VanDerWaalsContact O-CG 3.25Å; S741-R745 WeakPolarHBondContact O-CG 3.03Å; S741-R745 PolarHBondContact O-N 2.99Å
742	M	93.3	Very high	93.1	Very high	130 Å²	130	98.6 Å²	98.6	64%	0.64	49%	0.494	S	S	*	.	H	α-helix	trans	-64.9	-44.1	173.7	-178.6	170.6	62.3	0	0	111.9	N738 R739 R745 G746	N738-M742 WeakPolarHBondContact O-CB 3.23Å; N738-M742 PolarHBondContact O-N 3.18Å; R739-M742 WeakPolarHBondContact O-CB 3.4Å; R739-M742 PolarHBondContact O-N 3.44Å; M742-R745 PolarHBondContact O-N 3.4Å; M742-G746 PolarHBondContact O-N 3.29Å
743	E	94.6	Very high	93.1	Very high	75 Å²	75	98.7 Å²	98.7	35%	0.35	49%	0.494	S	S	.	.	H	α-helix	trans	-66.4	-38.2	176.8	-74.2	178.3	-153.3	0	0	112.9	R739 Q740 G746 K747	R739-E743 IonicContact CZ-OE1 2.74Å; R739-E743 IonicContact NH1-OE1 3.79Å; R739-E743 PolarHBondContact NH1-OE1 3.04Å; R739-E743 IonicContact NH1-OE2 2.94Å; R739-E743 PolarHBondContact O-N 3.09Å; Q740-E743 PolarHBondContact O-N 3.44Å; E743-G746 PolarHBondContact O-N 2.91Å; E743-K747 WeakPolarHBondContact O-CG 3.39Å; E743-K747 PolarHBondContact O-N 3.01Å; E743-K747 IonicContact OE2-NZ 2.71Å
744	A	94.6	Very high	92.9	Very high	57 Å²	57	94.8 Å²	94.8	47%	0.471	48%	0.484	S	S	.	.	H	α-helix	trans	-63.2	-41.3	173.8	0	0	0	0	0	111.5	Q740 K747 L748	Q740-A744 WeakPolarHBondContact O-CB 3.48Å; Q740-A744 PolarHBondContact O-N 3.49Å; A744-K747 PolarHBondContact O-N 3.32Å; A744-L748 WeakPolarHBondContact O-CB 3.38Å; A744-L748 PolarHBondContact O-N 3.44Å
745	R	93.2	Very high	92.2	Very high	173 Å²	173	98.9 Å²	98.9	65%	0.653	50%	0.502	S	S	*	.	H	α-helix	trans	-63.9	-40.5	173.1	-71.3	167	-177.3	-173.8	1	112	S741 M742 L748 L749	S741-R745 WeakPolarHBondContact O-CD 3.44Å; S741-R745 VanDerWaalsContact O-CG 3.25Å; S741-R745 WeakPolarHBondContact O-CG 3.03Å; S741-R745 PolarHBondContact O-N 2.99Å; M742-R745 PolarHBondContact O-N 3.4Å; R745-L748 PolarHBondContact O-N 3.4Å; R745-L749 WeakPolarHBondContact O-CG 3.3Å; R745-L749 PolarHBondContact O-N 3.26Å
746	G	94.3	Very high	91.4	Very high	38 Å²	38	103.5 Å²	103.5	39%	0.392	51%	0.51	S	S	.	.	H	α-helix	trans	-60.9	-48.1	173.7	0	0	0	0	0	112.7	M742 E743 L748 L749 Q750	M742-G746 PolarHBondContact O-N 3.29Å; E743-G746 PolarHBondContact O-N 2.91Å; G746-L748 VanDerWaalsContact C-N 3.34Å; G746-L748 PolarHBondContact O-N 2.84Å; G746-L749 PolarHBondContact O-N 2.88Å; G746-Q750 PolarHBondContact O-N 2.89Å
747	K	95.3	Very high	90.2	Very high	121 Å²	121	105.1 Å²	105.1	53%	0.526	52%	0.521	S	S	.	.	H	α-helix	trans	-62.9	-37.8	176.3	-71	164.3	-175.9	163.6	0	112.2	E743 A744 Q750 L751	E743-K747 WeakPolarHBondContact O-CG 3.39Å; E743-K747 PolarHBondContact O-N 3.01Å; E743-K747 IonicContact OE2-NZ 2.71Å; A744-K747 PolarHBondContact O-N 3.32Å; K747-Q750 PolarHBondContact O-N 3.48Å; K747-L751 WeakPolarHBondContact O-CG 3.48Å; K747-L751 PolarHBondContact O-N 3.46Å
748	L	95	Very high	88.4	Confident	101 Å²	101	105.6 Å²	105.6	53%	0.529	53%	0.528	S	S	.	.	H	α-helix	trans	-64	-43.8	174.2	179.3	60.7	0	0	0	112.1	A744 R745 G746 Q750 L751 I752	A744-L748 WeakPolarHBondContact O-CB 3.38Å; A744-L748 PolarHBondContact O-N 3.44Å; R745-L748 PolarHBondContact O-N 3.4Å; G746-L748 VanDerWaalsContact C-N 3.34Å; G746-L748 PolarHBondContact O-N 2.84Å; L748-Q750 VanDerWaalsContact C-N 3.32Å; L748-Q750 PolarHBondContact O-N 2.79Å; L748-L751 PolarHBondContact O-N 2.87Å; L748-I752 HydrophobicContact CD1-CD1 4.27Å; L748-I752 HydrophobicContact CG-CD1 4.06Å; L748-I752 VanDerWaalsContact O-CG1 3.31Å; L748-I752 WeakPolarHBondContact O-CG1 3.26Å; L748-I752 PolarHBondContact O-N 3.07Å
749	L	93.4	Very high	86.3	Confident	118 Å²	118	104 Å²	104	62%	0.618	54%	0.535	S	S	*	.	H	α-helix	trans	-62	-40	174.4	-71.8	168.9	0	0	0	111.7	R745 G746 L751 I752 E753	R745-L749 WeakPolarHBondContact O-CG 3.3Å; R745-L749 PolarHBondContact O-N 3.26Å; G746-L749 PolarHBondContact O-N 2.88Å; L749-L751 PolarHBondContact O-N 3.48Å; L749-I752 PolarHBondContact O-N 3.05Å; L749-E753 WeakPolarHBondContact O-CB 3.43Å; L749-E753 PolarHBondContact O-N 2.83Å
750	Q	91.9	Very high	84	Confident	111 Å²	111	105 Å²	105	52%	0.519	55%	0.548	S	S	.	.	H	α-helix	trans	-63.4	-38.9	175.4	-168.5	178.7	20.1	0	0	112.4	G746 K747 L748 E753 Q754	G746-Q750 PolarHBondContact O-N 2.89Å; K747-Q750 PolarHBondContact O-N 3.48Å; L748-Q750 VanDerWaalsContact C-N 3.32Å; L748-Q750 PolarHBondContact O-N 2.79Å; Q750-E753 PolarHBondContact O-N 3.13Å; Q750-Q754 WeakPolarHBondContact O-CG 3.33Å; Q750-Q754 PolarHBondContact O-N 3.31Å
751	L	92.8	Very high	81.3	Confident	102 Å²	102	107.3 Å²	107.3	53%	0.534	56%	0.563	S	S	.	*	H	α-helix	trans	-67.4	-38.7	174.5	-72.9	168.7	0	0	0	112.4	K747 L748 L749 E753 Q754 Q755	K747-L751 WeakPolarHBondContact O-CG 3.48Å; K747-L751 PolarHBondContact O-N 3.46Å; L748-L751 PolarHBondContact O-N 2.87Å; L749-L751 PolarHBondContact O-N 3.48Å; L751-E753 VanDerWaalsContact C-N 3.33Å; L751-Q754 PolarHBondContact O-N 3.3Å; L751-Q755 PolarHBondContact O-N 3.11Å
752	I	89.4	Confident	78.5	Confident	88 Å²	88	113.4 Å²	113.4	45%	0.451	59%	0.591	S	S	.	*	H	α-helix	trans	-64.2	-39.7	174	-68.7	164	0	0	0	110.6	L748 L749 K756	L748-I752 HydrophobicContact CD1-CD1 4.27Å; L748-I752 HydrophobicContact CG-CD1 4.06Å; L748-I752 VanDerWaalsContact O-CG1 3.31Å; L748-I752 WeakPolarHBondContact O-CG1 3.26Å; L748-I752 PolarHBondContact O-N 3.07Å; L749-I752 PolarHBondContact O-N 3.05Å; I752-K756 WeakPolarHBondContact O-CB 3.31Å; I752-K756 PolarHBondContact O-N 3.18Å
753	E	87.9	Confident	75.6	Confident	118 Å²	118	112.2 Å²	112.2	55%	0.551	60%	0.596	S	S	*	*	H	α-helix	trans	-66.8	-41	174.1	-176.5	163.4	-133.3	0	0	112.2	L749 Q750 L751 K756 L757	L749-E753 WeakPolarHBondContact O-CB 3.43Å; L749-E753 PolarHBondContact O-N 2.83Å; Q750-E753 PolarHBondContact O-N 3.13Å; L751-E753 VanDerWaalsContact C-N 3.33Å; E753-K756 WeakPolarHBondContact O-CB 3.25Å; E753-K756 PolarHBondContact O-N 3.44Å; E753-K756 VanDerWaalsContact O-N 3.16Å; E753-L757 HydrophobicContact CG-CD1 4.14Å; E753-L757 WeakPolarHBondContact O-CG 3.47Å; E753-L757 PolarHBondContact O-N 3.35Å
754	Q	86.8	Confident	73.5	Confident	99 Å²	99	113.6 Å²	113.6	46%	0.463	61%	0.612	S	S	.	*	H	α-helix	trans	-61.7	-44.4	173.8	-75.5	175.5	-2	0	0	112.2	Q750 L751 K756 L757 V758	Q750-Q754 WeakPolarHBondContact O-CG 3.33Å; Q750-Q754 PolarHBondContact O-N 3.31Å; L751-Q754 PolarHBondContact O-N 3.3Å; Q754-K756 VanDerWaalsContact C-N 3.28Å; Q754-K756 PolarHBondContact O-N 2.93Å; Q754-L757 PolarHBondContact O-N 3.26Å; Q754-V758 WeakPolarHBondContact O-CG2 3.46Å; Q754-V758 PolarHBondContact O-N 3.38Å
755	Q	77.2	Confident	71.2	Confident	156 Å²	156	116.7 Å²	116.7	73%	0.729	63%	0.627	S	S	*	*	H	α-helix	trans	-58.2	-40.6	172.3	-85.3	-171.1	-24.3	0	0	112.2	L751 G759	L751-Q755 PolarHBondContact O-N 3.11Å; Q755-G759 PolarHBondContact O-N 3.36Å
756	K	74.3	Confident	67.9	Low	157 Å²	157	117 Å²	117	68%	0.683	64%	0.638	S	S	*	*	H	α-helix	trans	-66.3	-35	177.8	-171.3	-175.5	177.2	-170	0	112.8	I752 E753 Q754	I752-K756 WeakPolarHBondContact O-CB 3.31Å; I752-K756 PolarHBondContact O-N 3.18Å; E753-K756 WeakPolarHBondContact O-CB 3.25Å; E753-K756 PolarHBondContact O-N 3.44Å; E753-K756 VanDerWaalsContact O-N 3.16Å; Q754-K756 VanDerWaalsContact C-N 3.28Å; Q754-K756 PolarHBondContact O-N 2.93Å
757	L	66.6	Low	65.3	Low	102 Å²	102	121.9 Å²	121.9	53%	0.534	65%	0.654	S	S	.	*	H	α-helix	trans	-76.3	-37.1	177.4	-70.7	169.7	0	0	0	112.7	E753 Q754 G759 L760	E753-L757 HydrophobicContact CG-CD1 4.14Å; E753-L757 WeakPolarHBondContact O-CG 3.47Å; E753-L757 PolarHBondContact O-N 3.35Å; Q754-L757 PolarHBondContact O-N 3.26Å; L757-G759 PolarHBondContact O-N 2.98Å; L757-L760 PolarHBondContact O-N 3.25Å
758	V	56	Low	62.5	Low	122 Å²	122	122.2 Å²	122.2	74%	0.739	67%	0.669	S	S	*	*	H	α-helix	trans	-61.8	-29.6	173.7	170.3	0	0	0	0	111.5	Q754 L760	Q754-V758 WeakPolarHBondContact O-CG2 3.46Å; Q754-V758 PolarHBondContact O-N 3.38Å; V758-L760 PolarHBondContact O-N 3.28Å
759	G	49.3	Very low	59.5	Low	66 Å²	66	122.3 Å²	122.3	68%	0.68	67%	0.673	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.1	1.4	177.7	0	0	0	0	0	117	Q755 L757	Q755-G759 PolarHBondContact O-N 3.36Å; L757-G759 PolarHBondContact O-N 2.98Å
760	L	48.6	Very low	56.4	Low	129 Å²	129	125.6 Å²	125.6	68%	0.675	69%	0.685	S	S	*	*	T	Hydrogen-bonded Turn	trans	-113.6	0.3	-168.8	-73.2	173	0	0	0	116.7	L757 V758	L757-L760 PolarHBondContact O-N 3.25Å; V758-L760 PolarHBondContact O-N 3.28Å
761	N	37.7	Very low	53.2	Low	146 Å²	146	128 Å²	128	78%	0.781	70%	0.701	S	S	*	*			trans	-116.4	97	-178.7	-71.5	-69.6	0	0	0	113.5
762	L	36.7	Very low	50.6	Low	172 Å²	172	129.6 Å²	129.6	90%	0.901	72%	0.717	S	S	*	*			trans	-81.3	160.1	158.8	-62.3	156.5	0	0	0	108.1
763	S	32.3	Very low	47.8	Very low	105 Å²	105	133.2 Å²	133.2	73%	0.734	74%	0.737	S	S	*	*			cis	-159.9	157.2	23.4	-174.7	0	0	0	0	111.5
764	P	51	Low	45	Very low	105 Å²	105	139.2 Å²	139.2	68%	0.682	75%	0.754	S	S	*	*			trans	-99.6	173.8	169	39.7	-35.6	0	0	0	113.5
765	P	44.8	Very low	42.3	Very low	121 Å²	121	138.5 Å²	138.5	79%	0.786	77%	0.765	S	S	*	*			trans	-132.6	152.8	135.1	39.4	-29.3	0	0	0	111.3
766	M	25.4	Very low	39.9	Very low	180 Å²	180	143 Å²	143	89%	0.887	78%	0.776	S	S	*	*			cis	-135.3	168.6	7.9	-62.9	173.7	57.2	0	0	111.5
767	L	38.1	Very low	37.8	Very low	141 Å²	141	141.9 Å²	141.9	74%	0.738	78%	0.782	S	S	*	*			trans	-137.6	161.5	175.1	-87.8	166.7	0	0	0	110.2	V769	L767-V769 HydrophobicContact CB-CG2 3.84Å; L767-V769 HydrophobicContact CD1-CG2 3.91Å; L767-V769 HydrophobicContact CD2-CG2 4.32Å; L767-V769 HydrophobicContact CG-CG2 4.26Å
768	P	37.7	Very low	36	Very low	128 Å²	128	146 Å²	146	83%	0.831	80%	0.799	S	S	*	*				-143.2	139.3	98.6	35.9	-20.8	0	0	0	113.6
769	V	31	Very low	34.9	Very low	102 Å²	102	143.9 Å²	143.9	62%	0.618	80%	0.801	S	S	*	*			cis	80	112.3	38.2	176.6	0	0	0	0	114.9	L767	L767-V769 HydrophobicContact CB-CG2 3.84Å; L767-V769 HydrophobicContact CD1-CG2 3.91Å; L767-V769 HydrophobicContact CD2-CG2 4.32Å; L767-V769 HydrophobicContact CG-CG2 4.26Å
770	Q	28.9	Very low	34	Very low	188 Å²	188	144.6 Å²	144.6	88%	0.879	80%	0.801	S	S	*	*				-161.6	103.6	127.8	-111.7	175.7	48.3	0	0	112.6
771	L	25.5	Very low	33.7	Very low	161 Å²	161	148.5 Å²	148.5	84%	0.843	81%	0.812	S	S	*	*	S	Bend	trans	-120.9	146.7	146.5	-110.9	82.4	0	0	0	107.2	L773	L771-L773 PolarHBondContact O-N 3.23Å
772	P	37.8	Very low	33.6	Very low	135 Å²	135	152.2 Å²	152.2	88%	0.877	82%	0.815	S	S	*	*			trans	-76	121.4	-169.4	-17.7	33.2	0	0	0	113.7
773	L	31.3	Very low	33.6	Very low	164 Å²	164	150.2 Å²	150.2	86%	0.859	81%	0.811	S	S	*	*			trans	-90.5	141.2	169.7	-169.8	81.5	0	0	0	110.2	L771	L771-L773 PolarHBondContact O-N 3.23Å
774	R	28.6	Very low	33.6	Very low	245 Å²	245	152.7 Å²	152.7	93%	0.925	81%	0.814	S	S	*	*			trans	-151.3	107.3	151.3	-122.2	175.4	-158.6	-147.9	2	115.6
775	A	28.6	Very low	32.6	Very low	83 Å²	83	155.7 Å²	155.7	69%	0.686	82%	0.819	S	S	*	*			trans	41.2	115.5	141.7	0	0	0	0	0	120.2
776	W	28.6	Very low	31.9	Very low	251 Å²	251	156.6 Å²	156.6	95%	0.951	82%	0.822	S	S	*	*			trans	-73	147.5	146.1	-80.3	53.9	0	0	0	110.7
777	T	28.9	Very low	32.1	Very low	133 Å²	133	153.3 Å²	153.3	82%	0.816	82%	0.817	S	S	*	*			trans	-139.4	110	147.2	51.8	0	0	0	0	110.3
778	E	30	Very low	32	Very low	189 Å²	189	154 Å²	154	88%	0.883	82%	0.819	S	S	*	*			trans	56.5	97.7	137.5	-157	154	-149.5	0	0	120.3
779	G	32.6	Very low	31.7	Very low	77 Å²	77	154.2 Å²	154.2	79%	0.794	82%	0.821	S	S	*	*				62.3	94.2	130	0	0	0	0	0	121.2
780	A	29.1	Very low	31.5	Very low	82 Å²	82	152.9 Å²	152.9	68%	0.678	83%	0.828	S	S	*	*				-174.5	125.5	129.1	0	0	0	0	0	113.8
781	K	42.8	Very low	31.6	Very low	210 Å²	210	148.9 Å²	148.9	91%	0.913	83%	0.827	S	S	*	*			trans	0.8	113.6	151	-55.1	171	-175.3	175.9	0	116.2
782	R	35.9	Very low	31.8	Very low	224 Å²	224	150.5 Å²	150.5	85%	0.845	83%	0.83	S	S	*	*			trans	-140.1	134.3	156.8	-51	-69.9	174	88.3	10.3	108.7
783	T	35.8	Very low	31.3	Very low	131 Å²	131	148.8 Å²	148.8	80%	0.804	83%	0.827	S	S	*	*			trans	-68.8	149.2	159.9	-37.6	0	0	0	0	108.4
784	I	33.7	Very low	31.4	Very low	156 Å²	156	146.6 Å²	146.6	80%	0.8	83%	0.826	S	S	*	*			trans	-112.9	108	164.9	-61.3	179.1	0	0	0	107
785	E	28.4	Very low	31.3	Very low	169 Å²	169	144 Å²	144	79%	0.79	82%	0.824	S	S	*	*			trans	-79.8	141.9	166.6	-65.2	-179.7	151.8	0	0	108.9
786	V	30.8	Very low	31.3	Very low	139 Å²	139	146 Å²	146	84%	0.842	83%	0.833	S	S	*	*			trans	-91.2	115.2	177.6	177.4	0	0	0	0	108.6
787	S	30.8	Very low	31.3	Very low	111 Å²	111	138.8 Å²	138.8	78%	0.776	82%	0.821	S	S	*	*			trans	-104.3	135.3	175.8	-67.5	0	0	0	0	111.6
788	I	34.2	Very low	31.3	Very low	155 Å²	155	141.9 Å²	141.9	80%	0.795	82%	0.823	S	S	*	*			trans	-82.3	143.5	179.8	-62.3	167.6	0	0	0	109.3	G790	I788-G790 PolarHBondContact O-N 2.76Å
789	P	32.2	Very low	31.1	Very low	134 Å²	134	138.7 Å²	138.7	87%	0.87	82%	0.821	S	S	*	*			trans	-64.3	129.4	-179.9	-21.3	33.5	0	0	0	112.8
790	G	27.1	Very low	30.7	Very low	74 Å²	74	140.7 Å²	140.7	76%	0.763	82%	0.823	S	S	*	*			trans	-136.6	132.8	177.1	0	0	0	0	0	111.9	I788	I788-G790 PolarHBondContact O-N 2.76Å
791	A	31.8	Very low	30.7	Very low	104 Å²	104	142.6 Å²	142.6	86%	0.86	83%	0.826	S	S	*	*			trans	-6.9	134.8	177.6	0	0	0	0	0	120.2
792	E	29.8	Very low	30.1	Very low	194 Å²	194	139 Å²	139	91%	0.907	82%	0.821	S	S	*	*			trans	-71.8	144.3	171.3	-57	-161.3	170.7	0	0	113.6
793	A	27.3	Very low	29.7	Very low	99 Å²	99	133.4 Å²	133.4	82%	0.818	82%	0.816	S	S	*	*			trans	-149.2	129.3	158.2	0	0	0	0	0	109.3
794	S	31.6	Very low	30.5	Very low	119 Å²	119	132.6 Å²	132.6	83%	0.832	81%	0.813	S	S	*	*			trans	-84.1	145.9	-170.8	-46.9	0	0	0	0	113.9
795	E	27.5	Very low	30.1	Very low	189 Å²	189	131.4 Å²	131.4	88%	0.883	81%	0.813	S	S	*	*			trans	-71	141.6	167.7	-59.1	-175.5	153.9	0	0	112.1
796	S	28.3	Very low	30	Very low	125 Å²	125	128.7 Å²	128.7	87%	0.874	81%	0.813	S	S	*	*			trans	-167.9	157.8	130.9	52.9	0	0	0	0	110.9
797	S	28	Very low	29.7	Very low	100 Å²	100	126 Å²	126	70%	0.699	81%	0.813	S	S	*	*			trans	-120.7	139.8	-178.2	56.6	0	0	0	0	111.8
798	K	30.1	Very low	29.6	Very low	198 Å²	198	127.9 Å²	127.9	86%	0.861	81%	0.813	S	S	*	*				170.9	130.3	125.1	-90	151.3	-169.2	172.9	0	113.9
799	C	24.7	Very low	29.2	Very low	123 Å²	123	127.2 Å²	127.2	83%	0.831	81%	0.811	S	S	*	*			trans	5.1	121.7	150.6	-161.9	0	0	0	0	119.9
800	S	25.1	Very low	29	Very low	119 Å²	119	126.3 Å²	126.3	83%	0.832	80%	0.803	S	S	*	*				-158.3	166.3	119.5	-161.4	0	0	0	0	110.8
801	T	29.6	Very low	29.4	Very low	122 Å²	122	131.9 Å²	131.9	75%	0.748	80%	0.801	S	S	*	*			trans	-98.3	166.4	-167.5	-49	0	0	0	0	113.2
802	V	29	Very low	29.8	Very low	134 Å²	134	136.6 Å²	136.6	81%	0.812	80%	0.796	S	S	*	*			trans	119.1	117	156.1	-179.3	0	0	0	0	114.9
803	S	28.1	Very low	30	Very low	107 Å²	107	132.3 Å²	132.3	75%	0.748	79%	0.788	S	S	*	*			trans	-100.8	-179	166.3	-44.5	0	0	0	0	108.6
804	P	52.2	Low	30.4	Very low	113 Å²	113	133.6 Å²	133.6	73%	0.734	79%	0.791	S	S	*	*			cis	-150	-156.8	17.1	41.8	-17.8	0	0	0	116
805	V	26	Very low	30.3	Very low	131 Å²	131	131 Å²	131	79%	0.794	78%	0.784	S	S	*	*			trans	89.6	139.3	145.9	157.6	0	0	0	0	121.6
806	S	25	Very low	30.8	Very low	112 Å²	112	127 Å²	127	78%	0.783	78%	0.782	S	S	*	*			trans	-34.3	155.2	173.9	-42.2	0	0	0	0	120.2
807	G	26.3	Very low	31.2	Very low	82 Å²	82	127.3 Å²	127.3	85%	0.845	78%	0.779	S	S	*	*			trans	-162.2	67.9	173.7	0	0	0	0	0	115.2
808	I	27.3	Very low	31.3	Very low	151 Å²	151	127.1 Å²	127.1	77%	0.774	78%	0.778	S	S	*	*			trans	-73.2	170.8	176	50	168	0	0	0	114.4
809	N	26.6	Very low	31.5	Very low	141 Å²	141	124.6 Å²	124.6	75%	0.754	77%	0.774	S	S	*	*			trans	84.3	132.8	175.9	-75.9	-36.2	0	0	0	117.3
810	T	28.6	Very low	31.9	Very low	115 Å²	115	123.3 Å²	123.3	71%	0.706	77%	0.766	S	S	*	*			cis	109.4	119.5	18.4	-69.9	0	0	0	0	111.9
811	R	34.2	Very low	32	Very low	191 Å²	191	123.5 Å²	123.5	72%	0.721	77%	0.766	S	S	*	*				173.6	123.8	125.2	-97.6	-171	177.4	-154.4	-0.5	115.1
812	R	40.6	Very low	32.3	Very low	203 Å²	203	123.1 Å²	123.1	77%	0.766	77%	0.768	S	S	*	*			trans	66.9	153.3	137.3	-62.9	177.6	-178.3	-152	-6.4	117.5
813	S	34.2	Very low	33.2	Very low	105 Å²	105	121.9 Å²	121.9	73%	0.734	76%	0.763	S	S	*	*			cis	-174.7	158.4	-5.1	36.7	0	0	0	0	107.3
814	S	34.9	Very low	33.4	Very low	125 Å²	125	124.9 Å²	124.9	87%	0.874	77%	0.77	S	S	*	*			cis	-168.2	173.7	-5.8	-90.6	0	0	0	0	106.6
815	G	29.1	Very low	32.4	Very low	66 Å²	66	127.4 Å²	127.4	68%	0.68	78%	0.777	S	S	*	*			cis	136.4	157	1.2	0	0	0	0	0	112
816	A	38.3	Very low	32.6	Very low	103 Å²	103	126.2 Å²	126.2	85%	0.851	78%	0.781	S	S	*	*			trans	76.8	125.6	176.6	0	0	0	0	0	116.5
817	T	36.8	Very low	32.6	Very low	133 Å²	133	127.3 Å²	127.3	82%	0.816	78%	0.783	S	S	*	*			cis	-141.8	-164	-4.2	65.2	0	0	0	0	107.9
818	S	31.3	Very low	32.7	Very low	95 Å²	95	129.3 Å²	129.3	66%	0.664	78%	0.784	S	S	*	*			cis	-169.2	179.1	-2.8	55.1	0	0	0	0	106.1
819	N	34	Very low	32.6	Very low	146 Å²	146	125.5 Å²	125.5	78%	0.781	78%	0.783	S	S	*	*			cis	-175.2	172.5	-30.9	-92.1	16.7	0	0	0	105.4
820	S	33.2	Very low	32.5	Very low	95 Å²	95	125.5 Å²	125.5	66%	0.664	79%	0.793	S	S	*	*			cis	179.4	137.1	-39.6	57.5	0	0	0	0	107
821	C	27.7	Very low	32.4	Very low	124 Å²	124	123.4 Å²	123.4	84%	0.838	80%	0.795	S	S	*	*			cis	-162.9	-177.6	-5.1	-94.3	0	0	0	0	109.1
822	S	35.1	Very low	32.1	Very low	113 Å²	113	124.7 Å²	124.7	79%	0.79	80%	0.8	S	S	*	*			trans	-63.6	176.9	168.3	-29.8	0	0	0	0	112.4
823	P	47.7	Very low	31.7	Very low	109 Å²	109	123.8 Å²	123.8	71%	0.708	80%	0.802	S	S	*	*			cis	-152.6	-173.7	31.6	45.5	-23.4	0	0	0	119.1
824	L	31.6	Very low	31.5	Very low	170 Å²	170	124.9 Å²	124.9	89%	0.89	80%	0.804	S	S	*	*			trans	46.5	154.8	143.8	-72.7	167.6	0	0	0	124.6
825	N	33	Very low	31.4	Very low	166 Å²	166	124.3 Å²	124.3	89%	0.888	80%	0.797	S	S	*	*			trans	-86.2	144.2	178.5	-68.5	-33	0	0	0	114
826	A	29	Very low	31.3	Very low	106 Å²	106	128.9 Å²	128.9	88%	0.876	81%	0.805	S	S	*	*			trans	-158.5	160	154.3	0	0	0	0	0	112.9
827	T	25.8	Very low	30.9	Very low	134 Å²	134	130.9 Å²	130.9	82%	0.822	80%	0.802	S	S	*	*			trans	-98.1	160.6	-164.7	-56.8	0	0	0	0	114.8
828	S	28.2	Very low	31	Very low	124 Å²	124	130.3 Å²	130.3	87%	0.867	80%	0.8	S	S	*	*			trans	77.8	144.9	158.4	-90.3	0	0	0	0	120.3
829	G	24.7	Very low	30.9	Very low	72 Å²	72	136.7 Å²	136.7	74%	0.742	81%	0.81	S	S	*	*			trans	170.9	7.9	157.1	0	0	0	0	0	125.6
830	S	25.1	Very low	30.8	Very low	140 Å²	140	134.2 Å²	134.2	98%	0.979	81%	0.81	S	S	*	*			trans	67	156	170.3	-162.6	0	0	0	0	118.3
831	G	25.5	Very low	30.6	Very low	72 Å²	72	139.7 Å²	139.7	74%	0.742	82%	0.822	S	S	*	*			trans	145.5	87	173.3	0	0	0	0	0	115.8
832	R	28.9	Very low	31.1	Very low	217 Å²	217	141.4 Å²	141.4	82%	0.819	82%	0.821	S	S	*	*			trans	-50.1	143.9	174.2	-84.1	173.5	156.9	-129.9	1.8	113.6
833	F	31.7	Very low	30.7	Very low	185 Å²	185	145.1 Å²	145.1	81%	0.811	83%	0.825	S	S	*	*				-173.6	126.4	96.9	-94.1	-67.8	0	0	0	113
834	T	29.4	Very low	30.1	Very low	127 Å²	127	149.2 Å²	149.2	78%	0.779	83%	0.832	S	S	*	*			trans	-83	159.1	163.6	-20.7	0	0	0	0	109.9
835	P	34.2	Very low	30.5	Very low	113 Å²	113	149 Å²	149	73%	0.734	83%	0.827	S	S	*	*				-147.7	147.6	106.5	35.6	-19.2	0	0	0	117.6
836	L	26.1	Very low	30.4	Very low	162 Å²	162	149.1 Å²	149.1	85%	0.848	83%	0.827	S	S	*	*			trans	58.1	102.7	140.5	-65.6	167.1	0	0	0	121.5
837	N	29.4	Very low	30.7	Very low	146 Å²	146	150.4 Å²	150.4	78%	0.781	82%	0.815	S	S	*	*			trans	-88.9	141.1	152.9	171.1	-7.5	0	0	0	110.1	R839	N837-R839 PolarHBondContact OD1-N 2.68Å
838	P	39.5	Very low	31.3	Very low	121 Å²	121	151.2 Å²	151.2	79%	0.786	81%	0.809	S	S	*	*			trans	-120.7	81.5	160.8	37.2	-26.1	0	0	0	114.7
839	R	29.4	Very low	31.9	Very low	228 Å²	228	148.1 Å²	148.1	86%	0.86	80%	0.798	S	S	*	*			trans	32.1	102.2	131.4	-161.6	179.6	-164.9	-176.2	5.3	118.6	N837	N837-R839 PolarHBondContact OD1-N 2.68Å
840	A	32.4	Very low	32.4	Very low	94 Å²	94	156.9 Å²	156.9	78%	0.777	81%	0.808	S	S	*	*			trans	48.2	140.2	135.7	0	0	0	0	0	122.5
841	K	29.2	Very low	32.9	Very low	211 Å²	211	159.7 Å²	159.7	92%	0.917	80%	0.803	S	S	*	*			trans	-149.4	148.8	139.7	-115.7	172.3	-174.7	-178.1	0	111.8
842	I	38.1	Very low	33.5	Very low	159 Å²	159	161 Å²	161	82%	0.815	81%	0.807	S	S	*	*			trans	-98.4	140.4	175.8	-66	160.7	0	0	0	107.9
843	E	25.6	Very low	34.2	Very low	191 Å²	191	158.2 Å²	158.2	89%	0.893	81%	0.808	S	S	*	*			trans	-148.4	162.6	155.1	-159.8	141.4	-154.5	0	0	111.3
844	K	35.5	Very low	34.4	Very low	196 Å²	196	154.6 Å²	154.6	85%	0.852	81%	0.806	S	S	*	*			trans	-95.3	179	-167.6	-71	-179.9	176.2	178	0	113.1
845	Q	40.2	Very low	34.8	Very low	166 Å²	166	154.7 Å²	154.7	78%	0.776	81%	0.806	S	S	*	*			trans	-57.1	157.3	173.8	-63.3	177.5	-18.1	0	0	113.2
846	N	30.9	Very low	34.9	Very low	167 Å²	167	158.6 Å²	158.6	89%	0.893	81%	0.814	S	S	*	*			trans	-140.7	155.6	144.4	-86.4	-57.7	0	0	0	108.2
847	E	34.7	Very low	35.5	Very low	133 Å²	133	156.9 Å²	156.9	62%	0.621	81%	0.81	S	S	*	*			trans	-96.8	-169.9	-169.5	-61.6	-175.8	102	0	0	113
848	E	38.9	Very low	35.8	Very low	151 Å²	151	159.2 Å²	159.2	71%	0.706	84%	0.838	S	S	*	*			trans	49	116.3	173.7	-78.8	82.2	-108	0	0	121.7
849	G	39.9	Very low	35.7	Very low	60 Å²	60	161.1 Å²	161.1	62%	0.619	84%	0.84	S	S	*	*				99.2	85.7	89.8	0	0	0	0	0	118.8
850	W	35.7	Very low	36	Very low	255 Å²	255	157.6 Å²	157.6	97%	0.966	84%	0.839	S	S	*	*			trans	-136.7	95.7	155.5	-75.4	87.6	0	0	0	111
851	F	35.4	Very low	36.2	Very low	200 Å²	200	161.1 Å²	161.1	88%	0.877	84%	0.843	S	S	*	*			trans	-77	123.4	164.5	-77.5	-89.8	0	0	0	109.3
852	A	39.1	Very low	36.6	Very low	100 Å²	100	158.2 Å²	158.2	83%	0.826	84%	0.838	S	S	*	*			trans	-99.1	91.3	167.6	0	0	0	0	0	109.1
853	L	42.5	Very low	36.5	Very low	158 Å²	158	158.1 Å²	158.1	83%	0.827	84%	0.84	S	S	*	*			trans	-76.1	127	169	-71.7	172.3	0	0	0	109.4
854	S	36	Very low	37.2	Very low	109 Å²	109	155.9 Å²	155.9	76%	0.762	84%	0.836	S	S	*	*			trans	-149.9	79.3	167.1	-71.5	0	0	0	0	109
855	T	38.6	Very low	37.4	Very low	128 Å²	128	153.1 Å²	153.1	79%	0.785	84%	0.835	S	S	*	*			trans	4.7	122.3	148.2	51.1	0	0	0	0	117.1
856	H	35.8	Very low	37.1	Very low	195 Å²	195	152.1 Å²	152.1	90%	0.903	84%	0.839	S	S	*	*			trans	-70.5	132.8	155.1	-68.1	-90.2	0	0	0	109.8
857	V	37.8	Very low	37.7	Very low	127 Å²	127	150.8 Å²	150.8	77%	0.77	84%	0.835	S	S	*	*			trans	-140.7	121.7	155.3	-179.6	0	0	0	0	106.2
858	S	37.6	Very low	37.9	Very low	194 Å²	194	152.5 Å²	152.5	100%	1.357	85%	0.854	S	S	*	*			trans	27.3	0	170.4	-53	0	0	0	0	117.8

Retrieved 858 of 858 residues in 174.8 ms (Link to these results)

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