A0A3Q0KNY7_SCHMA Loading...

Putative sh3 and multiple ankyrin repeat domains protein 1,2 (Shank1,2)

AlphaFold DB , UniProt , Accession A0A3Q0KNY7, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,133 aa.

						>A0A3Q0KNY7_SCHMA|A0A3Q0KNY7
MPIQHFSLEKTTNYTPTPSIQLTNGNECKVLIAITVPTRNWKYIFKVRTDILISELRKQAIETYNLKEIDFLNHGLYLPPDSGKKGKFLQDERTISEYPQLVAIKLNLLNDDQLMNDTELINDNKSKEPVVLELLPKIRFVEEYRLEGSKSITKRINSKHHQKRLLSAIKRDDIGRVTDLLEQGLDPNFQYPSSGVIPLGCAAELADPREMILQLVNAGAHLDYRDSDTMTALHRAAINGNFKAIEVFLELGQNPNVRDKNDLTPLYYACSEDIRPECIQRLLYDHAILGVTDDKGRQEIHQACLNGRSKTLKQLIIYGADLNAQVENHNTPLHLCVLADEMECLLLLLRYGALPTIINSSGQTPYELAILIERMNLAKILQNFDENLIEGIDQKPVYNKDRRPTIHGPRAVYDSVHFPQYNNNNNNNGNNNNNSNPTSTRKPSKAMSVDRELPPTPYQRCLSFDMNDLRQITPKRINQYVFHNKVDFRTPDIARRNSVDKKEGTMNNNNNNSSSSSNNNNRPSLPIRRQMTYSNNNDNYGGTIYNHNNLQGIPKFSRRLNFIRQRYQNYCLRSIILERGTTGYGFIMQGSDNFKERSFIANNLPSQSILSVQPNSKAEKAGLAPGDYILEINGIDVYDATHKEVVDLITTTKDMLQLKIINFQQLPEIQPRVINGNHNNNNTNANLNHSNNNTKMMNRTSFVRADLRRRNTQRSTSVDMARINRPLSIDNNIMANNHKITINTTNTTTNNDYNSGSSTNNDQVTNTNYKSILPDQKFSSEQHFRRLVSDTGNNTNSNTNNNTTNNNSYRRSIQSLNPGKSQSAVLIIENETDQLKNSLGTTITTQPLSSPSTSSSSPHIINTYAYTTNINNGSSELKQPEIDQSTITIHNGLTNKQDQHQFIMKSLSSSTSTTPLSPSSSSFSSQPHLYSSSSSPLKYKQDNKIIHSLKPFEPFTQNTGYSISHSQHHPHHHDDLSDSKWDSESDLLNISEITEISVNSMNDGNFKKIMNLNHKCNIGQVELHEKPTNMMNPSSVVITPSLLLSSSSSSISSPVKNRLTIKVNSNMNGKMRSIHSEPLLYQMKTETDHDNNDNNNHSCNDEEISTVPKTSINNNLILNGHEIDDDESDSCLI
					

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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	31.8	Very low	29.1	Very low	227 Å²	227	156.5 Å²	156.5	100%	1.118	79%	0.793	S	S	*	*				0	104.2	0	-68.1	-58.2	-172.5	0	0	108.9	I3	M1-I3 PolarHBondContact O-N 3.04Å
2	P	30	Very low	29	Very low	124 Å²	124	153.8 Å²	153.8	81%	0.805	79%	0.79	S	S	*	*			trans	-80.6	113	173.5	31.5	-30	0	0	0	109.8	Q4	P2-Q4 PolarHBondContact O-N 3.5Å
3	I	32.9	Very low	28.7	Very low	163 Å²	163	150.2 Å²	150.2	84%	0.836	77%	0.773	S	S	*	*			trans	-75	122.9	164.8	-62.9	176.9	0	0	0	106.5	M1 H5	M1-I3 PolarHBondContact O-N 3.04Å; I3-H5 PolarHBondContact O-N 2.84Å
4	Q	32.3	Very low	28.7	Very low	166 Å²	166	148.8 Å²	148.8	78%	0.776	75%	0.754	S	S	*	*			trans	-65.4	126.6	-172.4	-70.2	171.3	-56.2	0	0	111.2	P2 F6	P2-Q4 PolarHBondContact O-N 3.5Å; Q4-F6 PolarHBondContact O-N 3.36Å
5	H	29	Very low	28.5	Very low	177 Å²	177	141.9 Å²	141.9	82%	0.819	72%	0.723	S	S	*	*			trans	-68.4	97.4	168.8	-116.8	-104.3	0	0	0	109.1	I3 S7	I3-H5 PolarHBondContact O-N 2.84Å; H5-S7 VanDerWaalsContact C-N 3.27Å; H5-S7 PolarHBondContact O-N 2.63Å; H5-S7 VanDerWaalsContact O-N 3.12Å
6	F	30.3	Very low	28.3	Very low	181 Å²	181	140.4 Å²	140.4	79%	0.794	73%	0.725	S	S	*	*			trans	-80.6	81.7	162.6	-112.2	-81.4	0	0	0	108.7	Q4 L8	Q4-F6 PolarHBondContact O-N 3.36Å; F6-L8 PolarHBondContact O-N 3.35Å
7	S	27.4	Very low	28.6	Very low	76 Å²	76	138 Å²	138	53%	0.531	72%	0.719	S	S	.	*			trans	-65	102.4	172	-64.5	0	0	0	0	109.4	H5 E9	H5-S7 VanDerWaalsContact C-N 3.27Å; H5-S7 PolarHBondContact O-N 2.63Å; H5-S7 VanDerWaalsContact O-N 3.12Å; S7-E9 PolarHBondContact O-N 3.41Å
8	L	28	Very low	28.6	Very low	152 Å²	152	133.4 Å²	133.4	80%	0.796	70%	0.699	S	S	*	*			trans	-80.2	68.5	172.8	-106.9	164.4	0	0	0	110	F6 K10	F6-L8 PolarHBondContact O-N 3.35Å; L8-K10 VanDerWaalsContact C-N 3.33Å; L8-K10 PolarHBondContact O-N 3.48Å
9	E	25.5	Very low	28.5	Very low	166 Å²	166	131.4 Å²	131.4	78%	0.776	70%	0.697	S	S	*	*			trans	-68.4	91.5	169.8	-72	-178.7	173.9	0	0	109.7	S7	S7-E9 PolarHBondContact O-N 3.41Å
10	K	27.2	Very low	28.5	Very low	174 Å²	174	130.8 Å²	130.8	76%	0.757	69%	0.693	S	S	*	*			trans	-119.8	68.1	160.2	-79	-159	170	-163.8	0	109.8	L8 T12	L8-K10 VanDerWaalsContact C-N 3.33Å; L8-K10 PolarHBondContact O-N 3.48Å; K10-T12 PolarHBondContact O-N 3.31Å
11	T	25.6	Very low	28.4	Very low	116 Å²	116	130.1 Å²	130.1	71%	0.712	69%	0.685	S	S	*	*			trans	-72.1	74.1	165.4	51.5	0	0	0	0	109.7	N13	T11-N13 VanDerWaalsContact C-N 3.26Å; T11-N13 PolarHBondContact O-N 3.28Å; T11-N13 PolarHBondContact O-OD1 2.9Å
12	T	28	Very low	28.2	Very low	123 Å²	123	126 Å²	126	76%	0.755	67%	0.667	S	S	*	*			trans	-71.5	88.5	164.7	45.8	0	0	0	0	107.8	K10 Y14	K10-T12 PolarHBondContact O-N 3.31Å; T12-Y14 PolarHBondContact O-N 3.25Å
13	N	25.6	Very low	28.3	Very low	107 Å²	107	126 Å²	126	57%	0.572	67%	0.666	S	S	*	*			trans	-62.6	102.1	-174.2	-70.6	-20	0	0	0	111.1	T11 T15	T11-N13 VanDerWaalsContact C-N 3.26Å; T11-N13 PolarHBondContact O-N 3.28Å; T11-N13 PolarHBondContact O-OD1 2.9Å; N13-T15 PolarHBondContact O-N 2.85Å
14	Y	27.6	Very low	28.1	Very low	131 Å²	131	126.4 Å²	126.4	51%	0.514	67%	0.669	S	S	.	*			trans	-74	91.9	167.5	-120.6	-62.7	0	0	0	109.4	T12 R258 D262	T12-Y14 PolarHBondContact O-N 3.25Å; Y14-R258 PolarHBondContact OH-NH1 3.27Å; Y14-D262 HydrophobicContact CE2-CB 3.97Å; Y14-D262 VanDerWaalsContact CE2-OD2 3.3Å; Y14-D262 WeakPolarHBondContact CE2-OD2 3.45Å
15	T	26	Very low	28.1	Very low	46 Å²	46	121.4 Å²	121.4	28%	0.282	66%	0.662	S	S	.	*			trans	-69.2	132.8	172.1	48.9	0	0	0	0	109.5	N13 T17	N13-T15 PolarHBondContact O-N 2.85Å; T15-T17 VanDerWaalsContact C-N 3.32Å; T15-T17 PolarHBondContact O-N 3.4Å
16	P	25.8	Very low	28.8	Very low	117 Å²	117	118.5 Å²	118.5	76%	0.76	65%	0.653	S	S	*	*			trans	-73.1	86.7	176.5	28.4	-33.4	0	0	0	110	P18	P16-P18 WeakPolarHBondContact O-CA 3.37Å
17	T	33	Very low	30.1	Very low	100 Å²	100	115.1 Å²	115.1	61%	0.613	64%	0.639	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87	128.1	-172.8	49.8	0	0	0	0	114	T15	T15-T17 VanDerWaalsContact C-N 3.32Å; T15-T17 PolarHBondContact O-N 3.4Å
18	P	29.6	Very low	32.2	Very low	56 Å²	56	113.5 Å²	113.5	36%	0.364	63%	0.627	S	S	.	*	T	Hydrogen-bonded Turn	cis	-98.7	152	-44.2	35.7	-27.1	0	0	0	110.1	P16 I20	P16-P18 WeakPolarHBondContact O-CA 3.37Å; P18-I20 PolarHBondContact O-N 3.35Å
19	S	25.4	Very low	34.8	Very low	94 Å²	94	108.8 Å²	108.8	66%	0.657	60%	0.601	S	S	*	*	P	Polyproline II helix	trans	-58.2	122.5	158.8	43.6	0	0	0	0	109.4	Q21	S19-Q21 PolarHBondContact O-N 3.4Å; S19-Q21 VanDerWaalsContact O-N 3.14Å
20	I	28.3	Very low	37.8	Very low	120 Å²	120	100.9 Å²	100.9	62%	0.615	56%	0.564	S	S	*	*	P	Polyproline II helix	trans	-63.7	117.3	167	-63	176.6	0	0	0	105.8	P18 L22	P18-I20 PolarHBondContact O-N 3.35Å; I20-L22 HydrophobicContact CG2-CD2 4.3Å; I20-L22 HydrophobicContact CG2-CG 4.18Å; I20-L22 PolarHBondContact O-N 3.4Å
21	Q	26.7	Very low	40.7	Very low	116 Å²	116	94.8 Å²	94.8	54%	0.542	54%	0.539	S	S	.	.			trans	-69.5	83.8	174.2	-74.5	-178.4	-10.5	0	0	109.3	S19 T23 L572	S19-Q21 PolarHBondContact O-N 3.4Å; S19-Q21 VanDerWaalsContact O-N 3.14Å; Q21-T23 PolarHBondContact O-N 3.05Å; Q21-L572 PolarHBondContact NE2-O 2.68Å
22	L	29.2	Very low	43.9	Very low	140 Å²	140	89.2 Å²	89.2	73%	0.733	51%	0.505	S	S	*	.			trans	-70.2	70.9	169.8	-73	170.7	0	0	0	110	I20 N24 G25	I20-L22 HydrophobicContact CG2-CD2 4.3Å; I20-L22 HydrophobicContact CG2-CG 4.18Å; I20-L22 PolarHBondContact O-N 3.4Å; L22-N24 PolarHBondContact O-N 3.49Å; L22-N24 VanDerWaalsContact O-N 3.08Å; L22-G25 PolarHBondContact O-N 3.12Å
23	T	30.9	Very low	47	Very low	126 Å²	126	83.4 Å²	83.4	77%	0.773	47%	0.469	S	S	*	.	T	Hydrogen-bonded Turn	trans	20.5	77.5	154.3	57	0	0	0	0	115.6	Q21 G25	Q21-T23 PolarHBondContact O-N 3.05Å; T23-G25 PolarHBondContact O-N 2.94Å
24	N	28.1	Very low	50.3	Low	171 Å²	171	78.3 Å²	78.3	91%	0.914	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	40.6	41.5	166.8	-64	4.7	0	0	0	116.1	L22	L22-N24 PolarHBondContact O-N 3.49Å; L22-N24 VanDerWaalsContact O-N 3.08Å
25	G	33.5	Very low	53.4	Low	61 Å²	61	73.1 Å²	73.1	63%	0.629	42%	0.424	S	S	*	.			trans	-100.2	86.9	-178.9	0	0	0	0	0	113.6	L22 T23 E27	L22-G25 PolarHBondContact O-N 3.12Å; T23-G25 PolarHBondContact O-N 2.94Å; G25-E27 PolarHBondContact O-N 3.48Å
26	N	43.6	Very low	56.4	Low	115 Å²	115	71 Å²	71	62%	0.615	41%	0.411	S	S	*	.			trans	21.3	84.1	167.6	-69	-3.6	0	0	0	116	C28	N26-C28 PolarHBondContact O-N 3.28Å
27	E	57.5	Low	59.3	Low	110 Å²	110	68.5 Å²	68.5	51%	0.514	40%	0.395	S	S	.	.			trans	-54.9	106.3	178.9	-70.6	-156.2	136.9	0	0	112.2	G25 K29 R48	G25-E27 PolarHBondContact O-N 3.48Å; E27-K29 PolarHBondContact O-N 3.2Å; E27-K29 VanDerWaalsContact OE2-CE 3.29Å; E27-K29 WeakPolarHBondContact OE2-CE 3.35Å; E27-K29 IonicContact OE2-NZ 2.98Å; E27-R48 VanDerWaalsContact OE1-CD 3.26Å; E27-R48 WeakPolarHBondContact OE1-CD 3.34Å; E27-R48 IonicContact OE1-NH1 3.63Å
28	C	70.6	Confident	61.5	Low	42 Å²	42	68.9 Å²	68.9	28%	0.284	40%	0.397	S	S	.	.			trans	-72.2	102.8	173.7	-72.6	0	0	0	0	109.7	N26 T49	N26-C28 PolarHBondContact O-N 3.28Å; C28-T49 HydrophobicContact CB-CG2 4.08Å; C28-T49 WeakPolarHBondContact O-CG2 2.98Å; C28-T49 PolarHBondContact O-N 3.37Å; C28-T49 PolarHBondContact O-OG1 3.04Å
29	K	83.7	Confident	64.1	Low	53 Å²	53	71.4 Å²	71.4	23%	0.23	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	144.6	170.6	-63.4	170.1	-173.4	170.9	0	109.9	E27 V47 R48 L106 D111	E27-K29 PolarHBondContact O-N 3.2Å; E27-K29 VanDerWaalsContact OE2-CE 3.29Å; E27-K29 WeakPolarHBondContact OE2-CE 3.35Å; E27-K29 IonicContact OE2-NZ 2.98Å; K29-V47 CarbonylContact C-O 3.53Å; K29-V47 VanDerWaalsContact CA-O 3.32Å; K29-V47 WeakPolarHBondContact CA-O 3.27Å; K29-R48 HydrophobicContact CG-CG 4.47Å; K29-L106 HydrophobicContact CB-CD1 4.3Å; K29-L106 PolarHBondContact O-N 3.47Å; K29-D111 IonicContact NZ-OD2 3.67Å; K29-D111 PolarHBondContact NZ-OD2 3.3Å
30	V	87.7	Confident	66.9	Low	0 Å²	0	74.3 Å²	74.3	0%	0	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	159.2	177.7	-64.4	0	0	0	0	110.8	I32 K46 V47 T49 I95	V30-I32 HydrophobicContact CG2-CD1 4.42Å; V30-I32 HydrophobicContact CG2-CG1 4.33Å; V30-K46 WeakPolarHBondContact O-CA 3.31Å; V30-V47 HydrophobicContact CG2-CG2 4.1Å; V30-V47 PolarHBondContact N-O 2.99Å; V30-V47 PolarHBondContact O-N 3.39Å; V30-T49 HydrophobicContact CG1-CG2 3.59Å; V30-T49 HydrophobicContact CG2-CG2 4.2Å; V30-I95 HydrophobicContact CG2-CG2 4.21Å
31	L	88.9	Confident	69.8	Low	46 Å²	46	73.5 Å²	73.5	24%	0.241	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	122.1	174.4	-60	178.9	0	0	0	110.6	I44 F45 K46 L106 P129	L31-I44 HydrophobicContact CB-CG2 4.31Å; L31-I44 HydrophobicContact CD2-CG2 4.47Å; L31-F45 WeakPolarHBondContact CA-O 3.48Å; L31-K46 HydrophobicContact CD2-CB 3.78Å; L31-K46 HydrophobicContact CD2-CG 4.04Å; L31-L106 HydrophobicContact CD1-CD2 4.42Å; L31-L106 HydrophobicContact CD2-CD1 4.08Å; L31-L106 HydrophobicContact CG-CD1 4.14Å; L31-L106 HydrophobicContact CG-CD2 4.48Å; L31-P129 HydrophobicContact CB-CB 3.91Å; L31-P129 WeakPolarHBondContact O-CB 3.07Å
32	I	91.6	Very high	72.9	Confident	0 Å²	0	74.2 Å²	74.2	0%	0	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	129	176.5	-62.6	-173.9	0	0	0	109.2	V30 I34 F45 V47 L56 I95 L101 L132	V30-I32 HydrophobicContact CG2-CD1 4.42Å; V30-I32 HydrophobicContact CG2-CG1 4.33Å; I32-I34 HydrophobicContact CG2-CG1 4.12Å; I32-F45 PolarHBondContact N-O 3.29Å; I32-F45 PolarHBondContact O-N 3.06Å; I32-V47 HydrophobicContact CD1-CG2 4.47Å; I32-L56 HydrophobicContact CD1-CD2 4.3Å; I32-I95 HydrophobicContact CD1-CD1 3.77Å; I32-I95 HydrophobicContact CD1-CG1 4.37Å; I32-I95 HydrophobicContact CD1-CG2 4.07Å; I32-L101 HydrophobicContact CD1-CB 4.23Å; I32-L101 HydrophobicContact CD1-CD1 4.4Å; I32-L132 HydrophobicContact CG2-CD1 3.7Å; I32-L132 HydrophobicContact CG2-CG 3.96Å
33	A	93.1	Very high	75.8	Confident	0 Å²	0	73.3 Å²	73.3	0%	0	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	119.1	172.4	0	0	0	0	0	109.7	Y43 I44 P129 V130 V131 L132	A33-Y43 CarbonylContact C-O 2.86Å; A33-Y43 WeakPolarHBondContact CA-O 3.31Å; A33-I44 HydrophobicContact CB-CG1 4.18Å; A33-P129 HydrophobicContact CB-CB 4.34Å; A33-P129 HydrophobicContact CB-CG 4.15Å; A33-V130 PolarHBondContact N-O 3.47Å; A33-V131 HydrophobicContact CB-CG2 4.27Å; A33-V131 CarbonylContact O-C 3.57Å; A33-V131 VanDerWaalsContact O-CA 3.32Å; A33-V131 WeakPolarHBondContact O-CA 3.3Å; A33-L132 PolarHBondContact O-N 3.43Å
34	I	94.9	Very high	78.8	Confident	0 Å²	0	71.5 Å²	71.5	0%	0	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	134.7	173.7	-56.2	173.8	0	0	0	108.1	I32 Y43 F45 L56 A60 Y64 L76 L132 L134	I32-I34 HydrophobicContact CG2-CG1 4.12Å; I34-Y43 PolarHBondContact N-O 3.3Å; I34-Y43 PolarHBondContact O-N 3.31Å; I34-Y43 VanDerWaalsContact O-N 3.1Å; I34-F45 HydrophobicContact CB-CD2 4.12Å; I34-F45 HydrophobicContact CB-CE2 3.8Å; I34-F45 HydrophobicContact CD1-CD2 3.76Å; I34-F45 HydrophobicContact CD1-CE2 3.85Å; I34-F45 HydrophobicContact CD1-CG 4.35Å; I34-F45 HydrophobicContact CD1-CZ 4.5Å; I34-F45 HydrophobicContact CG1-CD2 3.85Å; I34-F45 HydrophobicContact CG1-CE2 4Å; I34-L56 HydrophobicContact CD1-CD1 3.88Å; I34-L56 HydrophobicContact CD1-CD2 4.19Å; I34-L56 HydrophobicContact CD1-CG 3.78Å; I34-A60 HydrophobicContact CD1-CB 3.82Å; I34-A60 HydrophobicContact CG2-CB 4.18Å; I34-Y64 PolarHBondContact O-OH 3.25Å; I34-L76 HydrophobicContact CD1-CD1 4.3Å; I34-L76 HydrophobicContact CD1-CD2 4.06Å; I34-L76 HydrophobicContact CG1-CD2 4.42Å; I34-L76 HydrophobicContact CG2-CD2 3.75Å; I34-L132 CarbonylContact C-O 3.58Å; I34-L132 HydrophobicContact CG1-CB 4.41Å; I34-L134 HydrophobicContact CG2-CB 4.37Å
35	T	93.5	Very high	81.8	Confident	23 Å²	23	64 Å²	64	14%	0.141	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	153.9	179.9	58.7	0	0	0	0	111.6	W41 K42 V131 L132 E133 L134	T35-W41 CarbonylContact C-O 3.27Å; T35-W41 WeakPolarHBondContact CA-O 3.47Å; T35-K42 HydrophobicContact CG2-CB 4Å; T35-K42 HydrophobicContact CG2-CD 4.21Å; T35-K42 HydrophobicContact CG2-CG 3.83Å; T35-V131 HydrophobicContact CG2-CG1 3.95Å; T35-L132 PolarHBondContact N-O 2.89Å; T35-L132 PolarHBondContact OG1-O 2.84Å; T35-E133 WeakPolarHBondContact OG1-CA 3.18Å; T35-L134 PolarHBondContact O-N 3.03Å
36	V	90.1	Very high	84.5	Confident	0 Å²	0	65.1 Å²	65.1	0%	0	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	88.2	169.9	-170.9	0	0	0	0	107.8	T38 R39 N40 W41 Y64 L134	V36-T38 PolarHBondContact O-N 3.29Å; V36-T38 VanDerWaalsContact O-N 3.12Å; V36-R39 HydrophobicContact CG1-CB 4.3Å; V36-R39 HydrophobicContact CG1-CG 4.2Å; V36-R39 PolarHBondContact O-N 3.44Å; V36-N40 PolarHBondContact O-N 3.25Å; V36-W41 HydrophobicContact CB-CB 4.26Å; V36-W41 HydrophobicContact CG2-CB 4.48Å; V36-W41 PolarHBondContact N-O 2.92Å; V36-W41 PolarHBondContact O-N 2.9Å; V36-Y64 HydrophobicContact CG2-CD2 3.55Å; V36-Y64 HydrophobicContact CG2-CE2 3.48Å; V36-Y64 VanDerWaalsContact CG2-CE2 3.48Å; V36-Y64 HydrophobicContact CG2-CG 4.14Å; V36-L134 HydrophobicContact CG2-CB 4.42Å; V36-L134 HydrophobicContact CG2-CD2 4.36Å
37	P	84.9	Confident	86.7	Confident	65 Å²	65	60.1 Å²	60.1	42%	0.422	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.7	-29.6	-170.3	-29.1	37.4	0	0	0	114.4	R39 N40 E133 L135	P37-R39 PolarHBondContact O-N 2.95Å; P37-N40 PolarHBondContact O-N 2.92Å; P37-E133 HydrophobicContact CG-CB 4.06Å; P37-E133 HydrophobicContact CG-CG 3.93Å; P37-L135 HydrophobicContact CG-CD2 4.03Å
38	T	79.7	Confident	88.2	Confident	108 Å²	108	59 Å²	59	66%	0.663	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.4	-13.3	176.5	53.8	0	0	0	0	114.4	V36	V36-T38 PolarHBondContact O-N 3.29Å; V36-T38 VanDerWaalsContact O-N 3.12Å
39	R	83.8	Confident	88.9	Confident	110 Å²	110	58.1 Å²	58.1	42%	0.415	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-123.5	-1.6	178.6	-59.5	-172	179.2	-162.4	1.6	113.5	V36 P37 W41	V36-R39 HydrophobicContact CG1-CB 4.3Å; V36-R39 HydrophobicContact CG1-CG 4.2Å; V36-R39 PolarHBondContact O-N 3.44Å; P37-R39 PolarHBondContact O-N 2.95Å; R39-W41 HydrophobicContact CB-CD2 3.65Å; R39-W41 HydrophobicContact CB-CE3 4.13Å; R39-W41 HydrophobicContact CB-CG 3.81Å; R39-W41 HydrophobicContact CB-CZ2 4.44Å; R39-W41 VanDerWaalsContact CD-CZ3 3.49Å; R39-W41 HydrophobicContact CG-CD2 4.45Å; R39-W41 VanDerWaalsContact NH1-CZ3 3.34Å; R39-W41 PolarHBondContact O-N 2.65Å; R39-W41 PolarHBondContact O-NE1 3.1Å
40	N	84.3	Confident	89	Confident	154 Å²	154	59.3 Å²	59.3	82%	0.824	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.3	38	-170.7	-163	38.4	0	0	0	113.6	V36 P37	V36-N40 PolarHBondContact O-N 3.25Å; P37-N40 PolarHBondContact O-N 2.92Å
41	W	89.8	Confident	89.1	Confident	104 Å²	104	59.7 Å²	59.7	39%	0.394	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	143.4	178	-63	-13.4	0	0	0	111.1	T35 V36 R39 Y64 L66	T35-W41 CarbonylContact C-O 3.27Å; T35-W41 WeakPolarHBondContact CA-O 3.47Å; V36-W41 HydrophobicContact CB-CB 4.26Å; V36-W41 HydrophobicContact CG2-CB 4.48Å; V36-W41 PolarHBondContact N-O 2.92Å; V36-W41 PolarHBondContact O-N 2.9Å; R39-W41 HydrophobicContact CB-CD2 3.65Å; R39-W41 HydrophobicContact CB-CE3 4.13Å; R39-W41 HydrophobicContact CB-CG 3.81Å; R39-W41 HydrophobicContact CB-CZ2 4.44Å; R39-W41 VanDerWaalsContact CD-CZ3 3.49Å; R39-W41 HydrophobicContact CG-CD2 4.45Å; R39-W41 VanDerWaalsContact NH1-CZ3 3.34Å; R39-W41 PolarHBondContact O-N 2.65Å; R39-W41 PolarHBondContact O-NE1 3.1Å; W41-Y64 HydrophobicContact CB-CD1 4.11Å; W41-Y64 HydrophobicContact CB-CE1 3.61Å; W41-Y64 HydrophobicContact CD2-CD1 4.27Å; W41-Y64 AromaticContact CE3-CD1 3.6Å; W41-Y64 HydrophobicContact CE3-CD1 3.6Å; W41-Y64 HydrophobicContact CE3-CE1 4.32Å; W41-Y64 AromaticContact CE3-CG 3.98Å; W41-Y64 HydrophobicContact CE3-CG 3.98Å; W41-Y64 HydrophobicContact CG-CE1 4.43Å; W41-Y64 HydrophobicContact CZ3-CD1 4.33Å; W41-Y64 HydrophobicContact CZ3-CG 4.49Å; W41-Y64 VanDerWaalsContact CZ3-O 3.27Å; W41-Y64 WeakPolarHBondContact CZ3-O 3.42Å; W41-L66 HydrophobicContact CZ3-CD2 3.89Å
42	K	92.1	Very high	89.1	Confident	131 Å²	131	59.7 Å²	59.7	57%	0.57	29%	0.286	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-141.5	136	175.1	-176.9	174.8	-179.2	-177	0	109.4	T35 Y64	T35-K42 HydrophobicContact CG2-CB 4Å; T35-K42 HydrophobicContact CG2-CD 4.21Å; T35-K42 HydrophobicContact CG2-CG 3.83Å; K42-Y64 WeakPolarHBondContact CA-OH 3.14Å; K42-Y64 PolarHBondContact N-OH 2.93Å
43	Y	90.7	Very high	89.1	Confident	120 Å²	120	59.7 Å²	59.7	47%	0.471	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	146.7	178.7	-166.3	-84.7	0	0	0	109.1	A33 I34 F45 T63 Y64	A33-Y43 CarbonylContact C-O 2.86Å; A33-Y43 WeakPolarHBondContact CA-O 3.31Å; I34-Y43 PolarHBondContact N-O 3.3Å; I34-Y43 PolarHBondContact O-N 3.31Å; I34-Y43 VanDerWaalsContact O-N 3.1Å; Y43-F45 HydrophobicContact CD1-CD1 4.29Å; Y43-F45 AromaticContact CD1-CD2 3.9Å; Y43-F45 HydrophobicContact CD1-CD2 3.9Å; Y43-F45 AromaticContact CD1-CE1 3.97Å; Y43-F45 HydrophobicContact CD1-CE1 3.97Å; Y43-F45 AromaticContact CD1-CE2 3.53Å; Y43-F45 HydrophobicContact CD1-CE2 3.53Å; Y43-F45 HydrophobicContact CD1-CG 4.25Å; Y43-F45 AromaticContact CD1-CZ 3.56Å; Y43-F45 HydrophobicContact CD1-CZ 3.56Å; Y43-F45 HydrophobicContact CE1-CD1 4.48Å; Y43-F45 HydrophobicContact CE1-CE1 4.3Å; Y43-F45 HydrophobicContact CE1-CZ 4.31Å; Y43-F45 HydrophobicContact CG-CE2 4.13Å; Y43-F45 HydrophobicContact CG-CZ 4.21Å; Y43-T63 HydrophobicContact CD1-CG2 3.91Å; Y43-T63 HydrophobicContact CD2-CG2 3.96Å; Y43-T63 HydrophobicContact CE1-CG2 3.91Å; Y43-T63 HydrophobicContact CE2-CG2 3.95Å; Y43-T63 HydrophobicContact CG-CG2 3.94Å; Y43-Y64 WeakPolarHBondContact CB-OH 2.96Å; Y43-Y64 PolarHBondContact N-OH 3.07Å
44	I	92.1	Very high	88.9	Confident	89 Å²	89	61.3 Å²	61.3	46%	0.456	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	120.1	-175.3	-57	169.9	0	0	0	109.1	L31 A33 P129	L31-I44 HydrophobicContact CB-CG2 4.31Å; L31-I44 HydrophobicContact CD2-CG2 4.47Å; A33-I44 HydrophobicContact CB-CG1 4.18Å; I44-P129 HydrophobicContact CD1-CG 4.11Å; I44-P129 HydrophobicContact CG1-CG 4.34Å; I44-P129 HydrophobicContact CG2-CB 4.31Å; I44-P129 HydrophobicContact CG2-CG 4.31Å
45	F	91.5	Very high	88.7	Confident	14 Å²	14	65.2 Å²	65.2	6%	0.061	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	126.4	-177.3	-64	-97.1	0	0	0	109.7	L31 I32 I34 Y43 V47 L56 A60 T63	L31-F45 WeakPolarHBondContact CA-O 3.48Å; I32-F45 PolarHBondContact N-O 3.29Å; I32-F45 PolarHBondContact O-N 3.06Å; I34-F45 HydrophobicContact CB-CD2 4.12Å; I34-F45 HydrophobicContact CB-CE2 3.8Å; I34-F45 HydrophobicContact CD1-CD2 3.76Å; I34-F45 HydrophobicContact CD1-CE2 3.85Å; I34-F45 HydrophobicContact CD1-CG 4.35Å; I34-F45 HydrophobicContact CD1-CZ 4.5Å; I34-F45 HydrophobicContact CG1-CD2 3.85Å; I34-F45 HydrophobicContact CG1-CE2 4Å; Y43-F45 HydrophobicContact CD1-CD1 4.29Å; Y43-F45 AromaticContact CD1-CD2 3.9Å; Y43-F45 HydrophobicContact CD1-CD2 3.9Å; Y43-F45 AromaticContact CD1-CE1 3.97Å; Y43-F45 HydrophobicContact CD1-CE1 3.97Å; Y43-F45 AromaticContact CD1-CE2 3.53Å; Y43-F45 HydrophobicContact CD1-CE2 3.53Å; Y43-F45 HydrophobicContact CD1-CG 4.25Å; Y43-F45 AromaticContact CD1-CZ 3.56Å; Y43-F45 HydrophobicContact CD1-CZ 3.56Å; Y43-F45 HydrophobicContact CE1-CD1 4.48Å; Y43-F45 HydrophobicContact CE1-CE1 4.3Å; Y43-F45 HydrophobicContact CE1-CZ 4.31Å; Y43-F45 HydrophobicContact CG-CE2 4.13Å; Y43-F45 HydrophobicContact CG-CZ 4.21Å; F45-V47 HydrophobicContact CB-CG1 4.05Å; F45-L56 HydrophobicContact CB-CD1 4.33Å; F45-L56 HydrophobicContact CG-CD1 4.48Å; F45-A60 HydrophobicContact CE2-CB 4.47Å; F45-A60 HydrophobicContact CZ-CB 4.01Å; F45-T63 HydrophobicContact CE1-CG2 4.23Å; F45-T63 HydrophobicContact CZ-CG2 4.05Å
46	K	90	Very high	88.7	Confident	83 Å²	83	64.1 Å²	64.1	36%	0.361	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	101.2	172.3	179.7	178.6	175.8	179.8	0	108.4	V30 L31 L106 D111	V30-K46 WeakPolarHBondContact O-CA 3.31Å; L31-K46 HydrophobicContact CD2-CB 3.78Å; L31-K46 HydrophobicContact CD2-CG 4.04Å; K46-L106 HydrophobicContact CD-CD1 4.36Å; K46-L106 HydrophobicContact CG-CD1 4.18Å; K46-D111 IonicContact NZ-OD1 3.63Å; K46-D111 PolarHBondContact NZ-OD1 3.02Å
47	V	89.7	Confident	88.9	Confident	10 Å²	10	65.2 Å²	65.2	6%	0.061	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	149.7	-166.7	-71	0	0	0	0	112.8	K29 V30 I32 F45 I51 L56 I95	K29-V47 CarbonylContact C-O 3.53Å; K29-V47 VanDerWaalsContact CA-O 3.32Å; K29-V47 WeakPolarHBondContact CA-O 3.27Å; V30-V47 HydrophobicContact CG2-CG2 4.1Å; V30-V47 PolarHBondContact N-O 2.99Å; V30-V47 PolarHBondContact O-N 3.39Å; I32-V47 HydrophobicContact CD1-CG2 4.47Å; F45-V47 HydrophobicContact CB-CG1 4.05Å; V47-I51 HydrophobicContact CB-CG2 4.31Å; V47-I51 HydrophobicContact CG1-CD1 4.36Å; V47-L56 HydrophobicContact CG1-CD1 4Å; V47-L56 HydrophobicContact CG2-CD1 4.35Å; V47-I95 HydrophobicContact CB-CD1 4.32Å; V47-I95 HydrophobicContact CG2-CD1 3.48Å; V47-I95 VanDerWaalsContact CG2-CD1 3.48Å
48	R	89	Confident	89.2	Confident	88 Å²	88	65.9 Å²	65.9	33%	0.332	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74	142	176.5	-49.5	-176.9	-56.7	110.4	20	109.5	E27 K29 D50 I51	E27-R48 VanDerWaalsContact OE1-CD 3.26Å; E27-R48 WeakPolarHBondContact OE1-CD 3.34Å; E27-R48 IonicContact OE1-NH1 3.63Å; K29-R48 HydrophobicContact CG-CG 4.47Å; R48-D50 WeakPolarHBondContact CB-OD1 3.37Å; R48-D50 IonicContact CZ-OD1 3.84Å; R48-D50 IonicContact CZ-OD2 3.64Å; R48-D50 IonicContact NE-OD1 3.78Å; R48-D50 VanDerWaalsContact NH1-CG 3.3Å; R48-D50 IonicContact NH1-OD1 2.73Å; R48-D50 PolarHBondContact NH1-OD1 2.91Å; R48-D50 VanDerWaalsContact NH1-OD1 3.07Å; R48-D50 IonicContact NH1-OD2 3.92Å; R48-D50 PolarHBondContact NH1-OD2 3.04Å; R48-D50 VanDerWaalsContact NH2-CG 3.34Å; R48-D50 IonicContact NH2-OD1 3.67Å; R48-D50 PolarHBondContact NH2-OD1 3.12Å; R48-D50 IonicContact NH2-OD2 2.64Å; R48-D50 PolarHBondContact NH2-OD2 3.03Å; R48-D50 PolarHBondContact O-N 3.26Å; R48-I51 WeakPolarHBondContact O-CB 3.42Å; R48-I51 WeakPolarHBondContact O-CG2 3.2Å; R48-I51 PolarHBondContact O-N 2.87Å
49	T	86.4	Confident	89.8	Confident	22 Å²	22	63.5 Å²	63.5	14%	0.135	29%	0.29	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.3	-14.3	-174.2	50.8	0	0	0	0	115.3	C28 V30 I95 S96 V102	C28-T49 HydrophobicContact CB-CG2 4.08Å; C28-T49 WeakPolarHBondContact O-CG2 2.98Å; C28-T49 PolarHBondContact O-N 3.37Å; C28-T49 PolarHBondContact O-OG1 3.04Å; V30-T49 HydrophobicContact CG1-CG2 3.59Å; V30-T49 HydrophobicContact CG2-CG2 4.2Å; T49-I95 PolarHBondContact O-N 2.83Å; T49-S96 WeakPolarHBondContact O-CB 3.12Å; T49-S96 PolarHBondContact O-N 2.82Å; T49-S96 PolarHBondContact O-OG 2.82Å; T49-V102 HydrophobicContact CG2-CG1 4.09Å
50	D	85.6	Confident	90.3	Very high	79 Å²	79	58.2 Å²	58.2	42%	0.422	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.4	-6.6	177	64.5	-47	0	0	0	114	R48 T94	R48-D50 WeakPolarHBondContact CB-OD1 3.37Å; R48-D50 IonicContact CZ-OD1 3.84Å; R48-D50 IonicContact CZ-OD2 3.64Å; R48-D50 IonicContact NE-OD1 3.78Å; R48-D50 VanDerWaalsContact NH1-CG 3.3Å; R48-D50 IonicContact NH1-OD1 2.73Å; R48-D50 PolarHBondContact NH1-OD1 2.91Å; R48-D50 VanDerWaalsContact NH1-OD1 3.07Å; R48-D50 IonicContact NH1-OD2 3.92Å; R48-D50 PolarHBondContact NH1-OD2 3.04Å; R48-D50 VanDerWaalsContact NH2-CG 3.34Å; R48-D50 IonicContact NH2-OD1 3.67Å; R48-D50 PolarHBondContact NH2-OD1 3.12Å; R48-D50 IonicContact NH2-OD2 2.64Å; R48-D50 PolarHBondContact NH2-OD2 3.03Å; R48-D50 PolarHBondContact O-N 3.26Å; D50-T94 WeakPolarHBondContact O-CG2 3.33Å
51	I	89.9	Confident	90.7	Very high	7 Å²	7	51.1 Å²	51.1	4%	0.036	23%	0.233	C	C	.	.	S	Bend	trans	-61.9	144.2	175.2	-160.3	-177	0	0	0	111.2	V47 R48 E55 T94 I95	V47-I51 HydrophobicContact CB-CG2 4.31Å; V47-I51 HydrophobicContact CG1-CD1 4.36Å; R48-I51 WeakPolarHBondContact O-CB 3.42Å; R48-I51 WeakPolarHBondContact O-CG2 3.2Å; R48-I51 PolarHBondContact O-N 2.87Å; I51-E55 HydrophobicContact CD1-CB 4.34Å; I51-E55 HydrophobicContact CD1-CG 4.05Å; I51-E55 HydrophobicContact CG1-CB 4.01Å; I51-E55 VanDerWaalsContact CG1-CD 3.4Å; I51-E55 HydrophobicContact CG1-CG 3.98Å; I51-E55 VanDerWaalsContact CG1-OE2 3.3Å; I51-E55 WeakPolarHBondContact CG1-OE2 3.47Å; I51-T94 CarbonylContact O-C 3.59Å; I51-T94 WeakPolarHBondContact O-CA 3.42Å; I51-I95 HydrophobicContact CG2-CD1 3.17Å; I51-I95 HydrophobicContact CG2-CG1 3.62Å; I51-I95 PolarHBondContact O-N 3.32Å
52	L	89.6	Confident	90.9	Very high	46 Å²	46	51.6 Å²	51.6	24%	0.241	24%	0.239	C	C	.	.	B	Isolated β-bridge	trans	-75.8	148.6	174.8	-68.3	173	0	0	0	112	S54 E55 L56 R93 T94 I406	L52-S54 VanDerWaalsContact C-N 3.27Å; L52-S54 PolarHBondContact O-N 3.19Å; L52-E55 HydrophobicContact CB-CB 4.22Å; L52-E55 PolarHBondContact O-N 3.23Å; L52-L56 PolarHBondContact O-N 3.44Å; L52-R93 WeakPolarHBondContact CA-O 3.02Å; L52-T94 HydrophobicContact CD2-CG2 4.02Å; L52-I406 HydrophobicContact CD2-CD1 4.49Å
53	I	91.4	Very high	90.9	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-60.2	-37	173.5	-67.5	-54.6	0	0	0	111.8	L56 R57 L76 L89 Q90 R93 I95 Y98 L101	I53-L56 PolarHBondContact O-N 2.89Å; I53-R57 WeakPolarHBondContact O-CB 3.41Å; I53-R57 PolarHBondContact O-N 3.49Å; I53-L76 HydrophobicContact CG2-CD1 4.34Å; I53-L89 HydrophobicContact CD1-CB 4.29Å; I53-L89 HydrophobicContact CD1-CD1 3.8Å; I53-L89 HydrophobicContact CG1-CB 4.12Å; I53-L89 HydrophobicContact CG2-CB 3.65Å; I53-Q90 WeakPolarHBondContact CB-O 3.19Å; I53-R93 WeakPolarHBondContact CG1-O 3.49Å; I53-R93 PolarHBondContact N-O 3.16Å; I53-I95 HydrophobicContact CD1-CG1 4.18Å; I53-Y98 HydrophobicContact CD1-CD2 4.32Å; I53-Y98 HydrophobicContact CD1-CE2 4.25Å; I53-Y98 HydrophobicContact CG1-CD2 4.41Å; I53-Y98 HydrophobicContact CG1-CE2 3.88Å; I53-L101 HydrophobicContact CD1-CD1 4.43Å
54	S	87.4	Confident	90.9	Very high	34 Å²	34	43.8 Å²	43.8	24%	0.238	21%	0.213	C	C	.	.	H	α-helix	trans	-63.1	-40.4	174.7	42.5	0	0	0	0	113.1	L52 R57 K58 D91	L52-S54 VanDerWaalsContact C-N 3.27Å; L52-S54 PolarHBondContact O-N 3.19Å; S54-R57 PolarHBondContact O-N 2.99Å; S54-K58 PolarHBondContact O-N 3.03Å; S54-D91 VanDerWaalsContact CB-O 3.25Å; S54-D91 WeakPolarHBondContact CB-O 3.48Å; S54-D91 PolarHBondContact N-O 3.12Å; S54-D91 VanDerWaalsContact N-O 3.07Å; S54-D91 PolarHBondContact OG-O 2.83Å
55	E	90.7	Very high	90.8	Very high	82 Å²	82	46.7 Å²	46.7	38%	0.383	23%	0.229	S	C	.	.	H	α-helix	trans	-69.3	-44.6	176.9	-170.9	-170.9	158.3	0	0	110.9	I51 L52 R57 K58 Q59	I51-E55 HydrophobicContact CD1-CB 4.34Å; I51-E55 HydrophobicContact CD1-CG 4.05Å; I51-E55 HydrophobicContact CG1-CB 4.01Å; I51-E55 VanDerWaalsContact CG1-CD 3.4Å; I51-E55 HydrophobicContact CG1-CG 3.98Å; I51-E55 VanDerWaalsContact CG1-OE2 3.3Å; I51-E55 WeakPolarHBondContact CG1-OE2 3.47Å; L52-E55 HydrophobicContact CB-CB 4.22Å; L52-E55 PolarHBondContact O-N 3.23Å; E55-R57 VanDerWaalsContact C-N 3.3Å; E55-R57 PolarHBondContact O-N 2.88Å; E55-K58 PolarHBondContact O-N 3.04Å; E55-K58 VanDerWaalsContact O-N 3.09Å; E55-Q59 WeakPolarHBondContact O-CG 3.19Å; E55-Q59 PolarHBondContact O-N 2.89Å; E55-Q59 PolarHBondContact OE1-NE2 2.83Å
56	L	93.9	Very high	90.7	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-58.6	-39.8	172.3	-178.9	66.7	0	0	0	112	I32 I34 F45 V47 L52 I53 A60 L76 I95 L132	I32-L56 HydrophobicContact CD1-CD2 4.3Å; I34-L56 HydrophobicContact CD1-CD1 3.88Å; I34-L56 HydrophobicContact CD1-CD2 4.19Å; I34-L56 HydrophobicContact CD1-CG 3.78Å; F45-L56 HydrophobicContact CB-CD1 4.33Å; F45-L56 HydrophobicContact CG-CD1 4.48Å; V47-L56 HydrophobicContact CG1-CD1 4Å; V47-L56 HydrophobicContact CG2-CD1 4.35Å; L52-L56 PolarHBondContact O-N 3.44Å; I53-L56 PolarHBondContact O-N 2.89Å; L56-A60 WeakPolarHBondContact O-CB 3.25Å; L56-A60 PolarHBondContact O-N 3.11Å; L56-L76 HydrophobicContact CB-CD1 4.14Å; L56-L76 HydrophobicContact CD2-CD1 3.71Å; L56-L76 HydrophobicContact CG-CD1 3.79Å; L56-I95 HydrophobicContact CD2-CD1 4.07Å; L56-I95 HydrophobicContact CD2-CG1 4.44Å; L56-L132 HydrophobicContact CD2-CD1 4.42Å
57	R	94	Very high	90.5	Very high	23 Å²	23	49.6 Å²	49.6	9%	0.087	24%	0.242	C	C	.	.	H	α-helix	trans	-63.5	-43.2	173.7	-175.5	-171.8	59.6	-144.5	-23.5	111.1	I53 S54 E55 A60 I61 H74 L76 D91 L134	I53-R57 WeakPolarHBondContact O-CB 3.41Å; I53-R57 PolarHBondContact O-N 3.49Å; S54-R57 PolarHBondContact O-N 2.99Å; E55-R57 VanDerWaalsContact C-N 3.3Å; E55-R57 PolarHBondContact O-N 2.88Å; R57-A60 WeakPolarHBondContact O-CB 3.3Å; R57-A60 PolarHBondContact O-N 3.42Å; R57-I61 HydrophobicContact CG-CD1 3.97Å; R57-I61 WeakPolarHBondContact O-CG1 3.5Å; R57-I61 PolarHBondContact O-N 3.22Å; R57-H74 WeakPolarHBondContact CD-O 3.49Å; R57-H74 PolarHBondContact NH1-O 2.67Å; R57-L76 HydrophobicContact CB-CD1 4.16Å; R57-L76 HydrophobicContact CB-CG 4.07Å; R57-L76 HydrophobicContact CG-CG 4.42Å; R57-D91 IonicContact CZ-OD1 2.67Å; R57-D91 VanDerWaalsContact CZ-OD1 3.26Å; R57-D91 IonicContact CZ-OD2 3.98Å; R57-D91 VanDerWaalsContact NH1-CG 3.33Å; R57-D91 IonicContact NH1-OD1 3.17Å; R57-D91 PolarHBondContact NH1-OD1 3.24Å; R57-D91 IonicContact NH1-OD2 3.54Å; R57-D91 PolarHBondContact NH1-OD2 3.13Å; R57-D91 VanDerWaalsContact NH2-CG 3.26Å; R57-D91 IonicContact NH2-OD1 3.19Å; R57-D91 PolarHBondContact NH2-OD1 2.98Å; R57-D91 IonicContact NH2-OD2 2.7Å; R57-D91 PolarHBondContact NH2-OD2 2.81Å; R57-L134 HydrophobicContact CG-CD1 3.93Å
58	K	91.4	Very high	90.2	Very high	80 Å²	80	53.8 Å²	53.8	35%	0.348	26%	0.261	S	S	.	.	H	α-helix	trans	-63.3	-48.5	179.1	-175.6	165.9	-175.8	123.5	0	111.2	S54 E55 A60 I61 E62 E68	S54-K58 PolarHBondContact O-N 3.03Å; E55-K58 PolarHBondContact O-N 3.04Å; E55-K58 VanDerWaalsContact O-N 3.09Å; K58-A60 PolarHBondContact O-N 3.03Å; K58-I61 WeakPolarHBondContact O-CB 3.28Å; K58-I61 PolarHBondContact O-N 3.23Å; K58-E62 WeakPolarHBondContact CE-OE1 3.48Å; K58-E62 HydrophobicContact CG-CG 4.42Å; K58-E62 WeakPolarHBondContact CG-OE1 3.44Å; K58-E62 WeakPolarHBondContact O-CG 3.44Å; K58-E62 PolarHBondContact O-N 2.8Å; K58-E68 VanDerWaalsContact NZ-CD 3.3Å; K58-E68 IonicContact NZ-OE1 2.72Å; K58-E68 PolarHBondContact NZ-OE1 2.95Å; K58-E68 IonicContact NZ-OE2 3.99Å; K58-E68 PolarHBondContact NZ-OE2 2.99Å
59	Q	93.7	Very high	89.8	Confident	57 Å²	57	55.2 Å²	55.2	27%	0.266	27%	0.274	S	S	.	.	H	α-helix	trans	-55.1	-38.7	173.2	-70.2	175.5	6.1	0	0	112.2	E55 T63	E55-Q59 WeakPolarHBondContact O-CG 3.19Å; E55-Q59 PolarHBondContact O-N 2.89Å; E55-Q59 PolarHBondContact OE1-NE2 2.83Å; Q59-T63 WeakPolarHBondContact O-CB 3.19Å; Q59-T63 PolarHBondContact O-N 2.99Å; Q59-T63 PolarHBondContact O-OG1 3.38Å
60	A	93.7	Very high	89.7	Confident	0 Å²	0	58.7 Å²	58.7	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-68	-43.5	175.3	0	0	0	0	0	113	I34 F45 L56 R57 K58 E62 T63 Y64	I34-A60 HydrophobicContact CD1-CB 3.82Å; I34-A60 HydrophobicContact CG2-CB 4.18Å; F45-A60 HydrophobicContact CE2-CB 4.47Å; F45-A60 HydrophobicContact CZ-CB 4.01Å; L56-A60 WeakPolarHBondContact O-CB 3.25Å; L56-A60 PolarHBondContact O-N 3.11Å; R57-A60 WeakPolarHBondContact O-CB 3.3Å; R57-A60 PolarHBondContact O-N 3.42Å; K58-A60 PolarHBondContact O-N 3.03Å; A60-E62 VanDerWaalsContact C-N 3.35Å; A60-T63 PolarHBondContact O-N 2.88Å; A60-Y64 WeakPolarHBondContact O-CB 3.46Å; A60-Y64 WeakPolarHBondContact O-CD2 3.38Å; A60-Y64 PolarHBondContact O-N 2.68Å
61	I	92.3	Very high	89.8	Confident	5 Å²	5	55.6 Å²	55.6	3%	0.026	28%	0.275	C	S	.	.	H	α-helix	trans	-59.1	-46.7	175.9	-73.3	168.9	0	0	0	110.4	R57 K58 N65 L66 E68 F71 L134	R57-I61 HydrophobicContact CG-CD1 3.97Å; R57-I61 WeakPolarHBondContact O-CG1 3.5Å; R57-I61 PolarHBondContact O-N 3.22Å; K58-I61 WeakPolarHBondContact O-CB 3.28Å; K58-I61 PolarHBondContact O-N 3.23Å; I61-N65 PolarHBondContact O-N 3.48Å; I61-L66 HydrophobicContact CB-CB 4.5Å; I61-L66 HydrophobicContact CG2-CB 3.96Å; I61-L66 WeakPolarHBondContact CG2-O 3.35Å; I61-L66 WeakPolarHBondContact O-CB 3.47Å; I61-L66 PolarHBondContact O-N 2.92Å; I61-E68 HydrophobicContact CG2-CB 4.34Å; I61-F71 HydrophobicContact CD1-CB 3.74Å; I61-F71 HydrophobicContact CG1-CB 4.03Å; I61-L134 HydrophobicContact CG1-CD2 4.21Å
62	E	93	Very high	89.6	Confident	114 Å²	114	56.5 Å²	56.5	53%	0.533	28%	0.28	S	S	.	.	H	α-helix	trans	-64.8	-48.9	178.2	-69.3	166.5	170.1	0	0	111.9	K58 A60 Y64 N65	K58-E62 WeakPolarHBondContact CE-OE1 3.48Å; K58-E62 HydrophobicContact CG-CG 4.42Å; K58-E62 WeakPolarHBondContact CG-OE1 3.44Å; K58-E62 WeakPolarHBondContact O-CG 3.44Å; K58-E62 PolarHBondContact O-N 2.8Å; A60-E62 VanDerWaalsContact C-N 3.35Å; E62-Y64 PolarHBondContact O-N 2.81Å; E62-N65 PolarHBondContact O-N 2.91Å
63	T	93.1	Very high	89.8	Confident	65 Å²	65	55.1 Å²	55.1	40%	0.399	27%	0.272	S	S	.	.	H	α-helix	trans	-59.8	-34.7	179.5	-60.3	0	0	0	0	112.4	Y43 F45 Q59 A60 N65	Y43-T63 HydrophobicContact CD1-CG2 3.91Å; Y43-T63 HydrophobicContact CD2-CG2 3.96Å; Y43-T63 HydrophobicContact CE1-CG2 3.91Å; Y43-T63 HydrophobicContact CE2-CG2 3.95Å; Y43-T63 HydrophobicContact CG-CG2 3.94Å; F45-T63 HydrophobicContact CE1-CG2 4.23Å; F45-T63 HydrophobicContact CZ-CG2 4.05Å; Q59-T63 WeakPolarHBondContact O-CB 3.19Å; Q59-T63 PolarHBondContact O-N 2.99Å; Q59-T63 PolarHBondContact O-OG1 3.38Å; A60-T63 PolarHBondContact O-N 2.88Å; T63-N65 VanDerWaalsContact C-N 3.31Å
64	Y	90.8	Very high	89.8	Confident	22 Å²	22	56.5 Å²	56.5	9%	0.086	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.2	5	176.2	-73.1	-53	0	0	0	114.3	I34 V36 W41 K42 Y43 A60 E62 L66	I34-Y64 PolarHBondContact O-OH 3.25Å; V36-Y64 HydrophobicContact CG2-CD2 3.55Å; V36-Y64 HydrophobicContact CG2-CE2 3.48Å; V36-Y64 VanDerWaalsContact CG2-CE2 3.48Å; V36-Y64 HydrophobicContact CG2-CG 4.14Å; W41-Y64 HydrophobicContact CB-CD1 4.11Å; W41-Y64 HydrophobicContact CB-CE1 3.61Å; W41-Y64 HydrophobicContact CD2-CD1 4.27Å; W41-Y64 AromaticContact CE3-CD1 3.6Å; W41-Y64 HydrophobicContact CE3-CD1 3.6Å; W41-Y64 HydrophobicContact CE3-CE1 4.32Å; W41-Y64 AromaticContact CE3-CG 3.98Å; W41-Y64 HydrophobicContact CE3-CG 3.98Å; W41-Y64 HydrophobicContact CG-CE1 4.43Å; W41-Y64 HydrophobicContact CZ3-CD1 4.33Å; W41-Y64 HydrophobicContact CZ3-CG 4.49Å; W41-Y64 VanDerWaalsContact CZ3-O 3.27Å; W41-Y64 WeakPolarHBondContact CZ3-O 3.42Å; K42-Y64 WeakPolarHBondContact CA-OH 3.14Å; K42-Y64 PolarHBondContact N-OH 2.93Å; Y43-Y64 WeakPolarHBondContact CB-OH 2.96Å; Y43-Y64 PolarHBondContact N-OH 3.07Å; A60-Y64 WeakPolarHBondContact O-CB 3.46Å; A60-Y64 WeakPolarHBondContact O-CD2 3.38Å; A60-Y64 PolarHBondContact O-N 2.68Å; E62-Y64 PolarHBondContact O-N 2.81Å; Y64-L66 HydrophobicContact CD2-CD1 4.46Å; Y64-L66 HydrophobicContact CG-CD1 4.49Å; Y64-L66 PolarHBondContact O-N 3.46Å
65	N	90.3	Very high	90.1	Very high	150 Å²	150	54.9 Å²	54.9	80%	0.802	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.8	46.7	-175.4	-164.1	4.3	0	0	0	111.9	I61 E62 T63	I61-N65 PolarHBondContact O-N 3.48Å; E62-N65 PolarHBondContact O-N 2.91Å; T63-N65 VanDerWaalsContact C-N 3.31Å
66	L	88.9	Confident	90.3	Very high	13 Å²	13	51 Å²	51	7%	0.068	25%	0.25	C	C	.	.			trans	-95.7	143.7	178.7	-59.7	176.8	0	0	0	109.8	W41 I61 Y64 E68 F71 L134	W41-L66 HydrophobicContact CZ3-CD2 3.89Å; I61-L66 HydrophobicContact CB-CB 4.5Å; I61-L66 HydrophobicContact CG2-CB 3.96Å; I61-L66 WeakPolarHBondContact CG2-O 3.35Å; I61-L66 WeakPolarHBondContact O-CB 3.47Å; I61-L66 PolarHBondContact O-N 2.92Å; Y64-L66 HydrophobicContact CD2-CD1 4.46Å; Y64-L66 HydrophobicContact CG-CD1 4.49Å; Y64-L66 PolarHBondContact O-N 3.46Å; L66-E68 PolarHBondContact O-N 3.06Å; L66-F71 HydrophobicContact CB-CD2 3.78Å; L66-F71 HydrophobicContact CB-CE2 3.91Å; L66-F71 HydrophobicContact CB-CG 4.35Å; L66-F71 HydrophobicContact CD1-CD1 4.02Å; L66-F71 HydrophobicContact CD1-CD2 4.19Å; L66-F71 HydrophobicContact CD1-CE1 3.8Å; L66-F71 HydrophobicContact CD1-CE2 3.99Å; L66-F71 HydrophobicContact CD1-CG 4.23Å; L66-F71 HydrophobicContact CD1-CZ 3.78Å; L66-F71 HydrophobicContact CD2-CD2 4.47Å; L66-F71 HydrophobicContact CD2-CE2 3.74Å; L66-F71 HydrophobicContact CD2-CZ 3.86Å; L66-F71 HydrophobicContact CG-CD2 4.36Å; L66-F71 HydrophobicContact CG-CE2 4.08Å; L66-F71 HydrophobicContact CG-CZ 4.27Å; L66-L134 HydrophobicContact CD1-CD2 3.99Å
67	K	86.5	Confident	90.2	Very high	144 Å²	144	51 Å²	51	63%	0.626	25%	0.25	S	C	*	.			trans	-73.2	121	173.4	-63.3	-177.9	-173.7	170	0	109.4	I69 D70 F71	K67-I69 PolarHBondContact O-N 3.23Å; K67-I69 VanDerWaalsContact O-N 3.15Å; K67-D70 HydrophobicContact CB-CB 4.24Å; K67-D70 WeakPolarHBondContact CD-OD2 3.22Å; K67-D70 PolarHBondContact O-N 3.25Å; K67-F71 PolarHBondContact O-N 3.03Å
68	E	82.4	Confident	90.1	Very high	99 Å²	99	51 Å²	51	46%	0.463	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.3	-36	-179.3	-172.1	166.4	-151	0	0	112.5	K58 I61 L66 F71 L72	K58-E68 VanDerWaalsContact NZ-CD 3.3Å; K58-E68 IonicContact NZ-OE1 2.72Å; K58-E68 PolarHBondContact NZ-OE1 2.95Å; K58-E68 IonicContact NZ-OE2 3.99Å; K58-E68 PolarHBondContact NZ-OE2 2.99Å; I61-E68 HydrophobicContact CG2-CB 4.34Å; L66-E68 PolarHBondContact O-N 3.06Å; E68-F71 CarbonylContact O-C 3.49Å; E68-F71 PolarHBondContact O-N 2.79Å; E68-L72 WeakPolarHBondContact O-CA 3.4Å; E68-L72 PolarHBondContact O-N 2.89Å
69	I	81.9	Confident	90	Very high	117 Å²	117	48.6 Å²	48.6	60%	0.6	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.1	-33.7	178.4	-161.9	160.6	0	0	0	114	K67 F71 L72	K67-I69 PolarHBondContact O-N 3.23Å; K67-I69 VanDerWaalsContact O-N 3.15Å; I69-F71 VanDerWaalsContact C-N 3.26Å; I69-F71 PolarHBondContact O-N 3.29Å; I69-L72 WeakPolarHBondContact O-CB 3.32Å
70	D	83.1	Confident	89.6	Confident	96 Å²	96	49 Å²	49	51%	0.513	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.2	-27.6	174.9	-61.8	-10	0	0	0	110.7	K67	K67-D70 HydrophobicContact CB-CB 4.24Å; K67-D70 WeakPolarHBondContact CD-OD2 3.22Å; K67-D70 PolarHBondContact O-N 3.25Å
71	F	87.7	Confident	89	Confident	13 Å²	13	53.4 Å²	53.4	6%	0.057	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.5	8.2	-178.6	-74.2	-96.3	0	0	0	113.9	I61 L66 K67 E68 I69 N73 H74 L134	I61-F71 HydrophobicContact CD1-CB 3.74Å; I61-F71 HydrophobicContact CG1-CB 4.03Å; L66-F71 HydrophobicContact CB-CD2 3.78Å; L66-F71 HydrophobicContact CB-CE2 3.91Å; L66-F71 HydrophobicContact CB-CG 4.35Å; L66-F71 HydrophobicContact CD1-CD1 4.02Å; L66-F71 HydrophobicContact CD1-CD2 4.19Å; L66-F71 HydrophobicContact CD1-CE1 3.8Å; L66-F71 HydrophobicContact CD1-CE2 3.99Å; L66-F71 HydrophobicContact CD1-CG 4.23Å; L66-F71 HydrophobicContact CD1-CZ 3.78Å; L66-F71 HydrophobicContact CD2-CD2 4.47Å; L66-F71 HydrophobicContact CD2-CE2 3.74Å; L66-F71 HydrophobicContact CD2-CZ 3.86Å; L66-F71 HydrophobicContact CG-CD2 4.36Å; L66-F71 HydrophobicContact CG-CE2 4.08Å; L66-F71 HydrophobicContact CG-CZ 4.27Å; K67-F71 PolarHBondContact O-N 3.03Å; E68-F71 CarbonylContact O-C 3.49Å; E68-F71 PolarHBondContact O-N 2.79Å; I69-F71 VanDerWaalsContact C-N 3.26Å; I69-F71 PolarHBondContact O-N 3.29Å; F71-N73 VanDerWaalsContact C-N 3.29Å; F71-N73 PolarHBondContact O-N 2.85Å; F71-H74 HydrophobicContact CB-CB 4.43Å; F71-H74 HydrophobicContact CD1-CB 4.13Å; F71-H74 AromaticContact CD1-CD2 3.5Å; F71-H74 AromaticContact CD1-CE1 3.9Å; F71-H74 AromaticContact CD1-CG 3.59Å; F71-H74 AromaticContact CD1-ND1 3.85Å; F71-H74 AromaticContact CD1-NE2 3.74Å; F71-H74 AromaticContact CE1-CD2 3.71Å; F71-H74 AromaticContact CE1-NE2 3.65Å; F71-H74 WeakPolarHBondContact O-CB 3.39Å; F71-H74 PolarHBondContact O-N 3.35Å; F71-L134 HydrophobicContact CD1-CD2 3.88Å; F71-L134 HydrophobicContact CD1-CG 4.28Å; F71-L134 HydrophobicContact CE1-CD2 4.23Å
72	L	86.8	Confident	88.1	Confident	27 Å²	27	58.5 Å²	58.5	14%	0.141	31%	0.311	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.2	-40.1	-176.3	-177	73.3	0	0	0	113.8	E68 I69 R225 T229	E68-L72 WeakPolarHBondContact O-CA 3.4Å; E68-L72 PolarHBondContact O-N 2.89Å; I69-L72 WeakPolarHBondContact O-CB 3.32Å; L72-R225 HydrophobicContact CD2-CB 3.94Å; L72-R225 HydrophobicContact CG-CB 4.26Å; L72-T229 HydrophobicContact CD1-CG2 4.24Å; L72-T229 HydrophobicContact CD2-CG2 3.55Å
73	N	92.8	Very high	87.3	Confident	16 Å²	16	57.1 Å²	57.1	9%	0.086	33%	0.327	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.7	28.6	175.5	-76.5	-34.9	0	0	0	112.2	F71 K137 Q190 Y224 R225	F71-N73 VanDerWaalsContact C-N 3.29Å; F71-N73 PolarHBondContact O-N 2.85Å; N73-K137 WeakPolarHBondContact O-CB 3.33Å; N73-K137 WeakPolarHBondContact O-CG 3Å; N73-K137 PolarHBondContact O-N 3.42Å; N73-Q190 PolarHBondContact ND2-NE2 3.1Å; N73-Y224 HydrophobicContact CB-CD2 4.25Å; N73-Y224 HydrophobicContact CB-CE2 3.82Å; N73-Y224 VanDerWaalsContact ND2-CE1 3.26Å; N73-Y224 WeakPolarHBondContact ND2-CE1 3.22Å; N73-R225 PolarHBondContact ND2-O 3.38Å; N73-R225 PolarHBondContact OD1-N 3.1Å
74	H	92.6	Very high	86.8	Confident	29 Å²	29	60.9 Å²	60.9	13%	0.134	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	154.7	165.4	-68.3	58.7	0	0	0	110.9	R57 F71 L134 L135	R57-H74 WeakPolarHBondContact CD-O 3.49Å; R57-H74 PolarHBondContact NH1-O 2.67Å; F71-H74 HydrophobicContact CB-CB 4.43Å; F71-H74 HydrophobicContact CD1-CB 4.13Å; F71-H74 AromaticContact CD1-CD2 3.5Å; F71-H74 AromaticContact CD1-CE1 3.9Å; F71-H74 AromaticContact CD1-CG 3.59Å; F71-H74 AromaticContact CD1-ND1 3.85Å; F71-H74 AromaticContact CD1-NE2 3.74Å; F71-H74 AromaticContact CE1-CD2 3.71Å; F71-H74 AromaticContact CE1-NE2 3.65Å; F71-H74 WeakPolarHBondContact O-CB 3.39Å; F71-H74 PolarHBondContact O-N 3.35Å; H74-L134 HydrophobicContact CB-CD1 3.88Å; H74-L134 HydrophobicContact CB-CG 4.33Å; H74-L135 CarbonylContact C-O 3.6Å; H74-L135 WeakPolarHBondContact CA-O 3.47Å; H74-L135 WeakPolarHBondContact CB-O 3.42Å
75	G	92.6	Very high	86.4	Confident	1 Å²	1	66.2 Å²	66.2	1%	0.01	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	157.9	175.3	0	0	0	0	0	110.7	Y77 L135	G75-Y77 PolarHBondContact O-N 2.94Å; G75-L135 PolarHBondContact N-O 3.37Å; G75-L135 PolarHBondContact O-N 3Å; G75-L135 VanDerWaalsContact O-N 3.1Å
76	L	94.2	Very high	86.1	Confident	0 Å²	0	59.5 Å²	59.5	0%	0	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75	114.3	168.4	-65.3	177.9	0	0	0	108.4	I34 I53 L56 R57 L89 L132 L134	I34-L76 HydrophobicContact CD1-CD1 4.3Å; I34-L76 HydrophobicContact CD1-CD2 4.06Å; I34-L76 HydrophobicContact CG1-CD2 4.42Å; I34-L76 HydrophobicContact CG2-CD2 3.75Å; I53-L76 HydrophobicContact CG2-CD1 4.34Å; L56-L76 HydrophobicContact CB-CD1 4.14Å; L56-L76 HydrophobicContact CD2-CD1 3.71Å; L56-L76 HydrophobicContact CG-CD1 3.79Å; R57-L76 HydrophobicContact CB-CD1 4.16Å; R57-L76 HydrophobicContact CB-CG 4.07Å; R57-L76 HydrophobicContact CG-CG 4.42Å; L76-L89 HydrophobicContact CB-CD1 4.22Å; L76-L89 PolarHBondContact O-N 2.98Å; L76-L132 HydrophobicContact CB-CD1 4.34Å; L76-L132 HydrophobicContact CD1-CD1 4.3Å; L76-L134 HydrophobicContact CD2-CB 4.49Å; L76-L134 HydrophobicContact CD2-CD1 4.16Å
77	Y	92.9	Very high	86.1	Confident	1 Å²	1	62.2 Å²	62.2	0%	0.004	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	127.5	176.7	-178.8	-101.7	0	0	0	109.5	G75 P79 G86 K87 F88 L132 E133 L135 F140	G75-Y77 PolarHBondContact O-N 2.94Å; Y77-P79 WeakPolarHBondContact O-CD 3.46Å; Y77-G86 VanDerWaalsContact CE2-C 3.43Å; Y77-G86 WeakPolarHBondContact CE2-O 3.47Å; Y77-G86 VanDerWaalsContact CZ-C 3.46Å; Y77-G86 VanDerWaalsContact OH-CA 3.29Å; Y77-G86 WeakPolarHBondContact OH-CA 3.33Å; Y77-G86 PolarHBondContact OH-O 2.87Å; Y77-G86 VanDerWaalsContact OH-O 3.1Å; Y77-K87 VanDerWaalsContact CD2-C 3.42Å; Y77-F88 HydrophobicContact CD2-CD1 4.28Å; Y77-F88 HydrophobicContact CD2-CD2 4.1Å; Y77-F88 HydrophobicContact CD2-CE1 4.33Å; Y77-F88 HydrophobicContact CD2-CE2 4.15Å; Y77-F88 HydrophobicContact CD2-CG 4.17Å; Y77-F88 HydrophobicContact CD2-CZ 4.26Å; Y77-L132 CarbonylContact O-C 3.5Å; Y77-L132 WeakPolarHBondContact O-CA 3.4Å; Y77-E133 WeakPolarHBondContact CB-O 3.23Å; Y77-E133 HydrophobicContact CD1-CB 4.4Å; Y77-E133 PolarHBondContact N-O 2.89Å; Y77-E133 PolarHBondContact O-N 2.84Å; Y77-L135 HydrophobicContact CD1-CD1 3.72Å; Y77-L135 HydrophobicContact CD2-CD1 4.48Å; Y77-L135 HydrophobicContact CE1-CD1 4.41Å; Y77-L135 HydrophobicContact CG-CD1 3.77Å; Y77-F140 HydrophobicContact CE1-CE2 4.31Å; Y77-F140 AromaticContact CE2-CD2 3.94Å; Y77-F140 HydrophobicContact CE2-CD2 3.94Å; Y77-F140 AromaticContact CE2-CE2 3.63Å; Y77-F140 HydrophobicContact CE2-CE2 3.63Å; Y77-F140 HydrophobicContact CE2-CZ 4.27Å; Y77-F140 AromaticContact CZ-CE2 3.48Å; Y77-F140 VanDerWaalsContact CZ-CE2 3.48Å; Y77-F140 AromaticContact CZ-CZ 3.78Å; Y77-F140 VanDerWaalsContact OH-CE2 3.23Å; Y77-F140 WeakPolarHBondContact OH-CE2 3.39Å; Y77-F140 WeakPolarHBondContact OH-CZ 3.49Å
78	L	91.8	Very high	86.4	Confident	22 Å²	22	57 Å²	57	12%	0.115	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	118	167.7	173.8	64.9	0	0	0	108.3	G86 K87 L89 Q100 L101 L132	L78-G86 CarbonylContact O-C 3.52Å; L78-G86 WeakPolarHBondContact O-CA 3.4Å; L78-K87 PolarHBondContact N-O 3.24Å; L78-K87 PolarHBondContact O-N 3.26Å; L78-L89 HydrophobicContact CB-CD2 4.1Å; L78-Q100 HydrophobicContact CD2-CG 3.74Å; L78-L101 HydrophobicContact CD1-CD2 4.23Å; L78-L132 HydrophobicContact CB-CD2 3.95Å; L78-L132 HydrophobicContact CD1-CD2 3.85Å
79	P	88.1	Confident	86.8	Confident	29 Å²	29	52.7 Å²	52.7	19%	0.188	30%	0.297	C	S	.	.	P	Polyproline II helix	trans	-59.4	157.7	177.6	-25.5	36.9	0	0	0	113.4	Y77 D81 V131 E133	Y77-P79 WeakPolarHBondContact O-CD 3.46Å; P79-D81 PolarHBondContact O-N 3.22Å; P79-V131 WeakPolarHBondContact CD-O 3.17Å; P79-E133 HydrophobicContact CG-CG 4.08Å; P79-E133 WeakPolarHBondContact CG-OE1 3.46Å
80	P	85.7	Confident	87	Confident	67 Å²	67	50.8 Å²	50.8	44%	0.435	29%	0.285	S	S	.	.	P	Polyproline II helix	trans	-64	132.6	170.9	27	-33.3	0	0	0	110.6	K84	P80-K84 VanDerWaalsContact CA-O 3.26Å; P80-K84 WeakPolarHBondContact CA-O 3.26Å; P80-K84 WeakPolarHBondContact CB-O 3.39Å
81	D	81.2	Confident	87.1	Confident	92 Å²	92	47.1 Å²	47.1	49%	0.492	27%	0.265	S	S	.	.	B	Isolated β-bridge	trans	-137.2	134.4	-178.8	165.3	38.1	0	0	0	109.6	P79 G83 K84	P79-D81 PolarHBondContact O-N 3.22Å; D81-G83 PolarHBondContact O-N 3.04Å; D81-G83 VanDerWaalsContact O-N 3.07Å; D81-K84 PolarHBondContact N-O 3.47Å; D81-K84 WeakPolarHBondContact O-CB 3.38Å; D81-K84 PolarHBondContact O-N 3.15Å
82	S	74.8	Confident	86.6	Confident	111 Å²	111	49.4 Å²	49.4	78%	0.776	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.1	42.5	168.1	-59.7	0	0	0	0	114.2	K84	S82-K84 VanDerWaalsContact C-N 3.32Å; S82-K84 PolarHBondContact O-N 2.88Å
83	G	76.1	Confident	86.4	Confident	85 Å²	85	52.1 Å²	52.1	88%	0.876	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.7	-8.6	-179.4	0	0	0	0	0	115.8	D81	D81-G83 PolarHBondContact O-N 3.04Å; D81-G83 VanDerWaalsContact O-N 3.07Å
84	K	82.1	Confident	86.2	Confident	144 Å²	144	51.9 Å²	51.9	63%	0.626	28%	0.284	S	S	*	.	B	Isolated β-bridge	trans	-78.9	133.5	172.3	-60.6	168.8	-174.5	162.8	0	109.5	P80 D81 S82	P80-K84 VanDerWaalsContact CA-O 3.26Å; P80-K84 WeakPolarHBondContact CA-O 3.26Å; P80-K84 WeakPolarHBondContact CB-O 3.39Å; D81-K84 PolarHBondContact N-O 3.47Å; D81-K84 WeakPolarHBondContact O-CB 3.38Å; D81-K84 PolarHBondContact O-N 3.15Å; S82-K84 VanDerWaalsContact C-N 3.32Å; S82-K84 PolarHBondContact O-N 2.88Å
85	K	81.9	Confident	86	Confident	135 Å²	135	50.5 Å²	50.5	59%	0.587	28%	0.277	S	S	*	.	P	Polyproline II helix	trans	-67.2	135	172.9	-62.5	-157.6	176.1	-154.6	0	110.3	E142	K85-E142 IonicContact NZ-OE1 2.76Å; K85-E142 IonicContact NZ-OE2 3.19Å; K85-E142 PolarHBondContact NZ-OE2 3Å
86	G	85	Confident	85.7	Confident	8 Å²	8	53.4 Å²	53.4	8%	0.082	30%	0.298	C	S	.	.	P	Polyproline II helix	trans	-72.5	147.3	175.8	0	0	0	0	0	111.3	Y77 L78	Y77-G86 VanDerWaalsContact CE2-C 3.43Å; Y77-G86 WeakPolarHBondContact CE2-O 3.47Å; Y77-G86 VanDerWaalsContact CZ-C 3.46Å; Y77-G86 VanDerWaalsContact OH-CA 3.29Å; Y77-G86 WeakPolarHBondContact OH-CA 3.33Å; Y77-G86 PolarHBondContact OH-O 2.87Å; Y77-G86 VanDerWaalsContact OH-O 3.1Å; L78-G86 CarbonylContact O-C 3.52Å; L78-G86 WeakPolarHBondContact O-CA 3.4Å
87	K	88.9	Confident	85.3	Confident	71 Å²	71	55.8 Å²	55.8	31%	0.309	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.9	154.4	-172.7	56.8	178.5	163.9	-170.6	0	113.1	Y77 L78 D465	Y77-K87 VanDerWaalsContact CD2-C 3.42Å; L78-K87 PolarHBondContact N-O 3.24Å; L78-K87 PolarHBondContact O-N 3.26Å; K87-D465 WeakPolarHBondContact CD-OD2 3.38Å; K87-D465 IonicContact NZ-OD2 3.78Å; K87-D465 PolarHBondContact NZ-OD2 3.04Å
88	F	91.3	Very high	85	Confident	35 Å²	35	56.6 Å²	56.6	15%	0.154	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.5	138.8	166.5	-72	-76.8	0	0	0	110.4	Y77 L135 P136 K137 H221	Y77-F88 HydrophobicContact CD2-CD1 4.28Å; Y77-F88 HydrophobicContact CD2-CD2 4.1Å; Y77-F88 HydrophobicContact CD2-CE1 4.33Å; Y77-F88 HydrophobicContact CD2-CE2 4.15Å; Y77-F88 HydrophobicContact CD2-CG 4.17Å; Y77-F88 HydrophobicContact CD2-CZ 4.26Å; F88-L135 HydrophobicContact CE1-CB 3.93Å; F88-L135 HydrophobicContact CZ-CB 3.99Å; F88-P136 WeakPolarHBondContact CZ-O 3.17Å; F88-K137 HydrophobicContact CE1-CG 4.48Å; F88-H221 AromaticContact CD2-CE1 3.9Å
89	L	91.5	Very high	84.7	Confident	8 Å²	8	60.2 Å²	60.2	4%	0.042	34%	0.337	C	S	.	.	P	Polyproline II helix	trans	-80.4	148.9	170.7	-56	178.5	0	0	0	109.1	I53 L76 L78 Y98 L101 L132	I53-L89 HydrophobicContact CD1-CB 4.29Å; I53-L89 HydrophobicContact CD1-CD1 3.8Å; I53-L89 HydrophobicContact CG1-CB 4.12Å; I53-L89 HydrophobicContact CG2-CB 3.65Å; L76-L89 HydrophobicContact CB-CD1 4.22Å; L76-L89 PolarHBondContact O-N 2.98Å; L78-L89 HydrophobicContact CB-CD2 4.1Å; L89-Y98 HydrophobicContact CB-CE2 4.28Å; L89-Y98 HydrophobicContact CD2-CD1 3.84Å; L89-Y98 HydrophobicContact CD2-CD2 4.23Å; L89-Y98 HydrophobicContact CD2-CE1 3.65Å; L89-Y98 HydrophobicContact CD2-CE2 4.05Å; L89-Y98 HydrophobicContact CD2-CG 4.11Å; L89-L101 HydrophobicContact CD1-CD1 3.94Å; L89-L132 HydrophobicContact CD1-CD1 3.81Å; L89-L132 HydrophobicContact CD1-CD2 3.92Å
90	Q	85.5	Confident	84.5	Confident	77 Å²	77	62 Å²	62	36%	0.36	34%	0.342	S	S	.	.	P	Polyproline II helix	trans	-89.1	124.9	-177.3	-75.3	-179.8	-40.8	0	0	109.8	I53 E92 R93 Y98	I53-Q90 WeakPolarHBondContact CB-O 3.19Å; Q90-E92 PolarHBondContact O-N 2.83Å; Q90-E92 VanDerWaalsContact O-N 3.14Å; Q90-R93 HydrophobicContact CB-CG 4.1Å; Q90-R93 PolarHBondContact O-N 3.18Å; Q90-R93 VanDerWaalsContact O-N 3.1Å; Q90-Y98 PolarHBondContact N-OH 2.82Å
91	D	84.8	Confident	84.4	Confident	18 Å²	18	58.9 Å²	58.9	10%	0.096	32%	0.322	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.6	-31.6	-171.9	-91.7	-11.5	0	0	0	113.4	S54 R57	S54-D91 VanDerWaalsContact CB-O 3.25Å; S54-D91 WeakPolarHBondContact CB-O 3.48Å; S54-D91 PolarHBondContact N-O 3.12Å; S54-D91 VanDerWaalsContact N-O 3.07Å; S54-D91 PolarHBondContact OG-O 2.83Å; R57-D91 IonicContact CZ-OD1 2.67Å; R57-D91 VanDerWaalsContact CZ-OD1 3.26Å; R57-D91 IonicContact CZ-OD2 3.98Å; R57-D91 VanDerWaalsContact NH1-CG 3.33Å; R57-D91 IonicContact NH1-OD1 3.17Å; R57-D91 PolarHBondContact NH1-OD1 3.24Å; R57-D91 IonicContact NH1-OD2 3.54Å; R57-D91 PolarHBondContact NH1-OD2 3.13Å; R57-D91 VanDerWaalsContact NH2-CG 3.26Å; R57-D91 IonicContact NH2-OD1 3.19Å; R57-D91 PolarHBondContact NH2-OD1 2.98Å; R57-D91 IonicContact NH2-OD2 2.7Å; R57-D91 PolarHBondContact NH2-OD2 2.81Å
92	E	77.4	Confident	84.4	Confident	61 Å²	61	55.7 Å²	55.7	29%	0.285	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.1	2.5	-177.1	76.5	-69	165.1	0	0	115.5	Q90	Q90-E92 PolarHBondContact O-N 2.83Å; Q90-E92 VanDerWaalsContact O-N 3.14Å
93	R	83.4	Confident	83.9	Confident	85 Å²	85	53.1 Å²	53.1	32%	0.321	29%	0.291	S	S	.	.	S	Bend	trans	-97.2	156.5	173.8	-64.8	-164.9	-166.2	-132.7	6.3	112.1	L52 I53 Q90 E97 Y98	L52-R93 WeakPolarHBondContact CA-O 3.02Å; I53-R93 WeakPolarHBondContact CG1-O 3.49Å; I53-R93 PolarHBondContact N-O 3.16Å; Q90-R93 HydrophobicContact CB-CG 4.1Å; Q90-R93 PolarHBondContact O-N 3.18Å; Q90-R93 VanDerWaalsContact O-N 3.1Å; R93-E97 WeakPolarHBondContact CA-OE1 3.41Å; R93-E97 HydrophobicContact CB-CB 4.38Å; R93-E97 VanDerWaalsContact CD-OE2 3.27Å; R93-E97 WeakPolarHBondContact CD-OE2 3.42Å; R93-E97 WeakPolarHBondContact CG-OE2 3.23Å; R93-E97 IonicContact NH1-OE2 2.74Å; R93-Y98 HydrophobicContact CB-CE2 3.86Å; R93-Y98 WeakPolarHBondContact CD-OH 3.33Å
94	T	88	Confident	83.3	Confident	10 Å²	10	50 Å²	50	6%	0.061	25%	0.254	C	S	.	.	B	Isolated β-bridge	trans	-86.4	160.8	170	62.4	0	0	0	0	111.8	D50 I51 L52 S96 E97 I406	D50-T94 WeakPolarHBondContact O-CG2 3.33Å; I51-T94 CarbonylContact O-C 3.59Å; I51-T94 WeakPolarHBondContact O-CA 3.42Å; L52-T94 HydrophobicContact CD2-CG2 4.02Å; T94-S96 PolarHBondContact O-N 2.87Å; T94-S96 PolarHBondContact OG1-OG 2.82Å; T94-E97 PolarHBondContact N-OE1 3.02Å; T94-E97 PolarHBondContact O-N 3.26Å; T94-E97 VanDerWaalsContact O-N 3.17Å; T94-E97 PolarHBondContact OG1-OE1 3.2Å; T94-I406 HydrophobicContact CG2-CD1 3.78Å
95	I	89	Confident	82.2	Confident	0 Å²	0	48.4 Å²	48.4	0%	0	25%	0.247	C	C	.	.	G	3₁₀ helix	trans	-55.7	-37.7	172.7	-64.6	177.9	0	0	0	111.4	V30 I32 V47 T49 I51 I53 L56 E97 Y98 L101 V102	V30-I95 HydrophobicContact CG2-CG2 4.21Å; I32-I95 HydrophobicContact CD1-CD1 3.77Å; I32-I95 HydrophobicContact CD1-CG1 4.37Å; I32-I95 HydrophobicContact CD1-CG2 4.07Å; V47-I95 HydrophobicContact CB-CD1 4.32Å; V47-I95 HydrophobicContact CG2-CD1 3.48Å; V47-I95 VanDerWaalsContact CG2-CD1 3.48Å; T49-I95 PolarHBondContact O-N 2.83Å; I51-I95 HydrophobicContact CG2-CD1 3.17Å; I51-I95 HydrophobicContact CG2-CG1 3.62Å; I51-I95 PolarHBondContact O-N 3.32Å; I53-I95 HydrophobicContact CD1-CG1 4.18Å; L56-I95 HydrophobicContact CD2-CD1 4.07Å; L56-I95 HydrophobicContact CD2-CG1 4.44Å; I95-E97 PolarHBondContact O-N 3.39Å; I95-E97 VanDerWaalsContact O-N 3.14Å; I95-Y98 PolarHBondContact O-N 3.21Å; I95-L101 HydrophobicContact CG2-CB 3.8Å; I95-L101 HydrophobicContact CG2-CD1 4.23Å; I95-V102 HydrophobicContact CG2-CG2 4.35Å
96	S	86.7	Confident	80.9	Confident	63 Å²	63	44.7 Å²	44.7	44%	0.441	23%	0.233	S	C	.	.	G	3₁₀ helix	trans	-60.4	-21.3	-179.6	60.5	0	0	0	0	114.6	T49 T94 Y98	T49-S96 WeakPolarHBondContact O-CB 3.12Å; T49-S96 PolarHBondContact O-N 2.82Å; T49-S96 PolarHBondContact O-OG 2.82Å; T94-S96 PolarHBondContact O-N 2.87Å; T94-S96 PolarHBondContact OG1-OG 2.82Å; S96-Y98 VanDerWaalsContact C-N 3.26Å; S96-Y98 PolarHBondContact O-N 3.39Å
97	E	84.4	Confident	79.1	Confident	50 Å²	50	50.5 Å²	50.5	23%	0.234	26%	0.263	C	S	.	.	G	3₁₀ helix	trans	-79.1	-6.3	176.2	-65.8	176.6	-121.7	0	0	113.9	R93 T94 I95 P99 R403	R93-E97 WeakPolarHBondContact CA-OE1 3.41Å; R93-E97 HydrophobicContact CB-CB 4.38Å; R93-E97 VanDerWaalsContact CD-OE2 3.27Å; R93-E97 WeakPolarHBondContact CD-OE2 3.42Å; R93-E97 WeakPolarHBondContact CG-OE2 3.23Å; R93-E97 IonicContact NH1-OE2 2.74Å; T94-E97 PolarHBondContact N-OE1 3.02Å; T94-E97 PolarHBondContact O-N 3.26Å; T94-E97 VanDerWaalsContact O-N 3.17Å; T94-E97 PolarHBondContact OG1-OE1 3.2Å; I95-E97 PolarHBondContact O-N 3.39Å; I95-E97 VanDerWaalsContact O-N 3.14Å; E97-P99 WeakPolarHBondContact O-CD 3.36Å; E97-R403 VanDerWaalsContact CD-NH2 3.29Å; E97-R403 IonicContact OE1-CZ 3.42Å; E97-R403 IonicContact OE1-NH1 2.69Å; E97-R403 PolarHBondContact OE1-NH1 2.8Å; E97-R403 IonicContact OE1-NH2 3.54Å; E97-R403 PolarHBondContact OE1-NH2 3.17Å; E97-R403 IonicContact OE2-CZ 3.19Å; E97-R403 IonicContact OE2-NH1 2.76Å; E97-R403 PolarHBondContact OE2-NH1 3.25Å; E97-R403 IonicContact OE2-NH2 3.57Å
98	Y	87.4	Confident	76.8	Confident	18 Å²	18	53.8 Å²	53.8	7%	0.071	28%	0.283	C	S	.	.			trans	-115.9	87.7	176.6	-64.8	-74.9	0	0	0	109.6	I53 L89 Q90 R93 I95 S96 Q100 L101	I53-Y98 HydrophobicContact CD1-CD2 4.32Å; I53-Y98 HydrophobicContact CD1-CE2 4.25Å; I53-Y98 HydrophobicContact CG1-CD2 4.41Å; I53-Y98 HydrophobicContact CG1-CE2 3.88Å; L89-Y98 HydrophobicContact CB-CE2 4.28Å; L89-Y98 HydrophobicContact CD2-CD1 3.84Å; L89-Y98 HydrophobicContact CD2-CD2 4.23Å; L89-Y98 HydrophobicContact CD2-CE1 3.65Å; L89-Y98 HydrophobicContact CD2-CE2 4.05Å; L89-Y98 HydrophobicContact CD2-CG 4.11Å; Q90-Y98 PolarHBondContact N-OH 2.82Å; R93-Y98 HydrophobicContact CB-CE2 3.86Å; R93-Y98 WeakPolarHBondContact CD-OH 3.33Å; I95-Y98 PolarHBondContact O-N 3.21Å; S96-Y98 VanDerWaalsContact C-N 3.26Å; S96-Y98 PolarHBondContact O-N 3.39Å; Y98-Q100 PolarHBondContact O-N 2.91Å; Y98-L101 HydrophobicContact CD2-CD1 4.17Å; Y98-L101 HydrophobicContact CG-CD1 4.17Å; Y98-L101 WeakPolarHBondContact O-CB 3.18Å; Y98-L101 PolarHBondContact O-N 2.89Å
99	P	84.9	Confident	74.2	Confident	98 Å²	98	58.4 Å²	58.4	64%	0.636	31%	0.309	S	S	*	.	G	3₁₀ helix	trans	-52.6	-32.2	-172.4	-29.5	36	0	0	0	114.7	E97 L101 V102	E97-P99 WeakPolarHBondContact O-CD 3.36Å; P99-L101 VanDerWaalsContact C-N 3.29Å; P99-L101 PolarHBondContact O-N 2.8Å; P99-V102 PolarHBondContact O-N 3.23Å; P99-V102 VanDerWaalsContact O-N 3.09Å
100	Q	83.4	Confident	71.6	Confident	66 Å²	66	63.4 Å²	63.4	31%	0.308	34%	0.335	S	S	.	.	G	3₁₀ helix	trans	-63.7	-26.9	176	66.6	-82	12.5	0	0	114.2	L78 Y98 V102	L78-Q100 HydrophobicContact CD2-CG 3.74Å; Y98-Q100 PolarHBondContact O-N 2.91Å; Q100-V102 VanDerWaalsContact C-N 3.3Å
101	L	85.6	Confident	69.6	Low	1 Å²	1	63.7 Å²	63.7	1%	0.005	34%	0.339	C	S	.	.	G	3₁₀ helix	trans	-79.6	-14.5	174.5	-51.9	-174.8	0	0	0	112.4	I32 I53 L78 L89 I95 Y98 P99 V130 L132	I32-L101 HydrophobicContact CD1-CB 4.23Å; I32-L101 HydrophobicContact CD1-CD1 4.4Å; I53-L101 HydrophobicContact CD1-CD1 4.43Å; L78-L101 HydrophobicContact CD1-CD2 4.23Å; L89-L101 HydrophobicContact CD1-CD1 3.94Å; I95-L101 HydrophobicContact CG2-CB 3.8Å; I95-L101 HydrophobicContact CG2-CD1 4.23Å; Y98-L101 HydrophobicContact CD2-CD1 4.17Å; Y98-L101 HydrophobicContact CG-CD1 4.17Å; Y98-L101 WeakPolarHBondContact O-CB 3.18Å; Y98-L101 PolarHBondContact O-N 2.89Å; P99-L101 VanDerWaalsContact C-N 3.29Å; P99-L101 PolarHBondContact O-N 2.8Å; L101-V130 HydrophobicContact CD2-CG1 3.8Å; L101-L132 HydrophobicContact CD2-CD2 4.04Å
102	V	81.1	Confident	67.7	Low	26 Å²	26	69.7 Å²	69.7	16%	0.158	37%	0.371	C	S	.	.	G	3₁₀ helix	trans	-102.5	7.1	-172.1	-165.9	0	0	0	0	112	T49 I95 P99 Q100 I104 K105	T49-V102 HydrophobicContact CG2-CG1 4.09Å; I95-V102 HydrophobicContact CG2-CG2 4.35Å; P99-V102 PolarHBondContact O-N 3.23Å; P99-V102 VanDerWaalsContact O-N 3.09Å; Q100-V102 VanDerWaalsContact C-N 3.3Å; V102-I104 PolarHBondContact O-N 3.14Å; V102-K105 HydrophobicContact CG1-CD 4.46Å; V102-K105 HydrophobicContact CG1-CG 4.06Å
103	A	64	Low	66.2	Low	56 Å²	56	72.8 Å²	72.8	46%	0.463	39%	0.386	S	S	.	.	S	Bend	trans	-61.2	-15.8	-178.6	0	0	0	0	0	114.5	K127	A103-K127 PolarHBondContact O-NZ 2.84Å
104	I	62.5	Low	64.4	Low	20 Å²	20	73.4 Å²	73.4	10%	0.103	40%	0.395	C	S	.	.			trans	-128.8	63.4	-171	-38.7	175.4	0	0	0	109.5	V102 L106 K127 E128 V130	V102-I104 PolarHBondContact O-N 3.14Å; I104-L106 PolarHBondContact O-N 3.47Å; I104-K127 HydrophobicContact CD1-CB 4.03Å; I104-K127 HydrophobicContact CG1-CB 4.05Å; I104-K127 HydrophobicContact CG1-CD 4.2Å; I104-K127 HydrophobicContact CG2-CB 4.07Å; I104-K127 HydrophobicContact CG2-CD 4.2Å; I104-E128 WeakPolarHBondContact CD1-O 3.41Å; I104-V130 HydrophobicContact CD1-CG2 4.22Å
105	K	60.1	Low	62.1	Low	111 Å²	111	80.6 Å²	80.6	48%	0.483	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.7	124.4	168.4	-64.2	-169.4	177	-167.4	0	109.6	V102 N107	V102-K105 HydrophobicContact CG1-CD 4.46Å; V102-K105 HydrophobicContact CG1-CG 4.06Å; K105-N107 PolarHBondContact O-N 2.97Å
106	L	54.9	Low	59.6	Low	56 Å²	56	87 Å²	87	29%	0.293	46%	0.464	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	99.3	166	-64	174.1	0	0	0	107.9	K29 L31 K46 I104 L108	K29-L106 HydrophobicContact CB-CD1 4.3Å; K29-L106 PolarHBondContact O-N 3.47Å; L31-L106 HydrophobicContact CD1-CD2 4.42Å; L31-L106 HydrophobicContact CD2-CD1 4.08Å; L31-L106 HydrophobicContact CG-CD1 4.14Å; L31-L106 HydrophobicContact CG-CD2 4.48Å; K46-L106 HydrophobicContact CD-CD1 4.36Å; K46-L106 HydrophobicContact CG-CD1 4.18Å; I104-L106 PolarHBondContact O-N 3.47Å; L106-L108 PolarHBondContact O-N 3.33Å
107	N	47	Very low	57	Low	131 Å²	131	88.6 Å²	88.6	70%	0.701	47%	0.468	S	S	*	.			trans	-72.4	124.7	169.5	-75.3	-5.7	0	0	0	108.9	K105 L109	K105-N107 PolarHBondContact O-N 2.97Å; N107-L109 PolarHBondContact O-N 3.03Å
108	L	39.5	Very low	54.9	Low	140 Å²	140	92.2 Å²	92.2	73%	0.733	49%	0.493	S	S	*	.	S	Bend	trans	-2.6	79.7	167.1	-65.8	167.5	0	0	0	115.6	L106	L106-L108 PolarHBondContact O-N 3.33Å
109	L	36.3	Very low	52.4	Low	132 Å²	132	99.5 Å²	99.5	69%	0.691	53%	0.528	S	S	*	.			trans	-115.5	135.9	163.2	-79	164.1	0	0	0	106.2	N107 D111	N107-L109 PolarHBondContact O-N 3.03Å; L109-D111 PolarHBondContact O-N 2.85Å
110	N	37.1	Very low	50.1	Low	112 Å²	112	101.2 Å²	101.2	60%	0.599	53%	0.531	S	S	*	.			trans	-58.4	127	-167.8	-59.4	-34.4	0	0	0	110.6	D112 Q113	N110-D112 PolarHBondContact O-N 2.88Å; N110-Q113 PolarHBondContact O-N 3.17Å
111	D	43.4	Very low	47.9	Very low	83 Å²	83	104.9 Å²	104.9	44%	0.444	55%	0.551	S	S	.	*	T	Hydrogen-bonded Turn	trans	-59.8	-21.6	-173.7	-90.8	-39.2	0	0	0	112.2	K29 K46 L109	K29-D111 IonicContact NZ-OD2 3.67Å; K29-D111 PolarHBondContact NZ-OD2 3.3Å; K46-D111 IonicContact NZ-OD1 3.63Å; K46-D111 PolarHBondContact NZ-OD1 3.02Å; L109-D111 PolarHBondContact O-N 2.85Å
112	D	45.7	Very low	45.4	Very low	144 Å²	144	111.7 Å²	111.7	77%	0.77	59%	0.588	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.2	-29.1	175.1	-57.5	-53.2	0	0	0	115.1	N110	N110-D112 PolarHBondContact O-N 2.88Å
113	Q	46.6	Very low	43.1	Very low	127 Å²	127	117.6 Å²	117.6	59%	0.593	62%	0.618	S	S	*	*	G	3₁₀ helix	trans	-80.7	-23.6	-178.8	-73.6	-170	-71.1	0	0	112.7	N110 M115	N110-Q113 PolarHBondContact O-N 3.17Å; Q113-M115 PolarHBondContact O-N 2.62Å
114	L	43.9	Very low	41.6	Very low	98 Å²	98	121.4 Å²	121.4	51%	0.513	63%	0.631	S	S	.	*	G	3₁₀ helix	trans	-80	2.3	-172.4	-137.6	82.5	0	0	0	114.7
115	M	41.4	Very low	40.4	Very low	161 Å²	161	131 Å²	131	79%	0.793	67%	0.672	S	S	*	*	G	3₁₀ helix	trans	-104.4	-11.4	-173.6	-73.6	-65	-170.6	0	0	115.2	Q113	Q113-M115 PolarHBondContact O-N 2.62Å
116	N	36.3	Very low	39.6	Very low	134 Å²	134	130 Å²	130	72%	0.717	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.5	-30.3	178.4	-73.4	-35.9	0	0	0	113.5	T118	N116-T118 VanDerWaalsContact C-N 3.31Å; N116-T118 PolarHBondContact O-N 2.91Å
117	D	32.1	Very low	39.8	Very low	96 Å²	96	133.9 Å²	133.9	51%	0.513	69%	0.694	S	S	.	*			trans	-79.9	73.6	-170.7	-67.8	-12.6	0	0	0	113	E119 L120	D117-E119 PolarHBondContact O-N 3.4Å; D117-L120 HydrophobicContact CB-CB 4.26Å; D117-L120 HydrophobicContact CB-CD1 3.96Å; D117-L120 HydrophobicContact CB-CG 4.27Å; D117-L120 WeakPolarHBondContact OD2-CD1 3.22Å
118	T	39.5	Very low	40.9	Very low	126 Å²	126	135.9 Å²	135.9	77%	0.773	70%	0.699	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.9	-8.8	172	-46.7	0	0	0	0	112.1	N116	N116-T118 VanDerWaalsContact C-N 3.31Å; N116-T118 PolarHBondContact O-N 2.91Å
119	E	35.9	Very low	42.9	Very low	171 Å²	171	130.5 Å²	130.5	80%	0.799	67%	0.672	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.1	-4.8	-171.3	-59.5	-166.9	130.9	0	0	115	D117 I121	D117-E119 PolarHBondContact O-N 3.4Å; E119-I121 PolarHBondContact O-N 3.23Å
120	L	36.1	Very low	45.3	Very low	135 Å²	135	125.7 Å²	125.7	71%	0.707	65%	0.648	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.5	15.4	-175.7	-106.5	177.7	0	0	0	115.5	D117	D117-L120 HydrophobicContact CB-CB 4.26Å; D117-L120 HydrophobicContact CB-CD1 3.96Å; D117-L120 HydrophobicContact CB-CG 4.27Å; D117-L120 WeakPolarHBondContact OD2-CD1 3.22Å
121	I	37.8	Very low	47.9	Very low	142 Å²	142	123 Å²	123	73%	0.728	64%	0.636	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88	-20.9	-174.8	-67.7	176	0	0	0	112.7	E119	E119-I121 PolarHBondContact O-N 3.23Å
122	N	33	Very low	50.3	Low	144 Å²	144	119 Å²	119	77%	0.77	62%	0.615	S	S	*	*	S	Bend	trans	-80.7	-21.6	-165.3	-73.9	-24.5	0	0	0	116.1
123	D	32.9	Very low	52.5	Low	150 Å²	150	113.9 Å²	113.9	80%	0.802	59%	0.586	S	S	*	*	S	Bend	trans	-133	75.3	-177	-96.6	-50.9	0	0	0	112.9
124	N	31.4	Very low	54.8	Low	137 Å²	137	107.9 Å²	107.9	73%	0.733	56%	0.558	S	S	*	*			trans	178.6	153.9	137.6	-102.2	-71.2	0	0	0	111.2	S126	N124-S126 WeakPolarHBondContact CB-OG 3.44Å; N124-S126 PolarHBondContact O-N 2.82Å
125	K	37.8	Very low	57	Low	221 Å²	221	104.7 Å²	104.7	96%	0.961	54%	0.541	S	S	*	.			trans	-75.5	30.9	173.6	-71.9	-178.3	174.3	176	0	113.5	K127	K125-K127 PolarHBondContact O-N 2.98Å
126	S	43.2	Very low	59.3	Low	89 Å²	89	99.3 Å²	99.3	62%	0.622	52%	0.518	S	S	*	.			trans	-93.9	77.9	-165.3	48.4	0	0	0	0	113.9	N124	N124-S126 WeakPolarHBondContact CB-OG 3.44Å; N124-S126 PolarHBondContact O-N 2.82Å
127	K	58.4	Low	61.9	Low	139 Å²	139	93.4 Å²	93.4	60%	0.604	49%	0.486	S	S	*	.			trans	65.1	91.7	152.4	-56.9	178.6	172.7	-169.1	0	117.3	A103 I104 K125	A103-K127 PolarHBondContact O-NZ 2.84Å; I104-K127 HydrophobicContact CD1-CB 4.03Å; I104-K127 HydrophobicContact CG1-CB 4.05Å; I104-K127 HydrophobicContact CG1-CD 4.2Å; I104-K127 HydrophobicContact CG2-CB 4.07Å; I104-K127 HydrophobicContact CG2-CD 4.2Å; K125-K127 PolarHBondContact O-N 2.98Å
128	E	70.7	Confident	64.4	Low	172 Å²	172	92.5 Å²	92.5	80%	0.804	48%	0.481	S	S	*	.	P	Polyproline II helix	trans	-60.4	143.7	163.1	-61.8	-169.5	140	0	0	112.4	I104	I104-E128 WeakPolarHBondContact CD1-O 3.41Å
129	P	82.6	Confident	66.5	Low	28 Å²	28	88.3 Å²	88.3	18%	0.182	45%	0.451	C	S	.	.	P	Polyproline II helix	trans	-62.8	140.8	179	27.4	-36	0	0	0	112.7	L31 A33 I44 V131	L31-P129 HydrophobicContact CB-CB 3.91Å; L31-P129 WeakPolarHBondContact O-CB 3.07Å; A33-P129 HydrophobicContact CB-CB 4.34Å; A33-P129 HydrophobicContact CB-CG 4.15Å; I44-P129 HydrophobicContact CD1-CG 4.11Å; I44-P129 HydrophobicContact CG1-CG 4.34Å; I44-P129 HydrophobicContact CG2-CB 4.31Å; I44-P129 HydrophobicContact CG2-CG 4.31Å; P129-V131 PolarHBondContact O-N 3.02Å
130	V	86.2	Confident	68	Low	30 Å²	30	82.6 Å²	82.6	18%	0.182	42%	0.423	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.9	129.8	-177.6	-173.7	0	0	0	0	110.1	A33 L101 I104	A33-V130 PolarHBondContact N-O 3.47Å; L101-V130 HydrophobicContact CD2-CG1 3.8Å; I104-V130 HydrophobicContact CD1-CG2 4.22Å
131	V	90.8	Very high	69.3	Low	56 Å²	56	77.7 Å²	77.7	34%	0.339	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	132.7	-173.6	-174.5	0	0	0	0	111.6	A33 T35 P79 P129	A33-V131 HydrophobicContact CB-CG2 4.27Å; A33-V131 CarbonylContact O-C 3.57Å; A33-V131 VanDerWaalsContact O-CA 3.32Å; A33-V131 WeakPolarHBondContact O-CA 3.3Å; T35-V131 HydrophobicContact CG2-CG1 3.95Å; P79-V131 WeakPolarHBondContact CD-O 3.17Å; P129-V131 PolarHBondContact O-N 3.02Å
132	L	93.9	Very high	70.1	Confident	0 Å²	0	76.4 Å²	76.4	0%	0	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	152.9	169.4	-59	178.9	0	0	0	110.3	I32 A33 I34 T35 L56 L76 Y77 L78 L89 L101	I32-L132 HydrophobicContact CG2-CD1 3.7Å; I32-L132 HydrophobicContact CG2-CG 3.96Å; A33-L132 PolarHBondContact O-N 3.43Å; I34-L132 CarbonylContact C-O 3.58Å; I34-L132 HydrophobicContact CG1-CB 4.41Å; T35-L132 PolarHBondContact N-O 2.89Å; T35-L132 PolarHBondContact OG1-O 2.84Å; L56-L132 HydrophobicContact CD2-CD1 4.42Å; L76-L132 HydrophobicContact CB-CD1 4.34Å; L76-L132 HydrophobicContact CD1-CD1 4.3Å; Y77-L132 CarbonylContact O-C 3.5Å; Y77-L132 WeakPolarHBondContact O-CA 3.4Å; L78-L132 HydrophobicContact CB-CD2 3.95Å; L78-L132 HydrophobicContact CD1-CD2 3.85Å; L89-L132 HydrophobicContact CD1-CD1 3.81Å; L89-L132 HydrophobicContact CD1-CD2 3.92Å; L101-L132 HydrophobicContact CD2-CD2 4.04Å
133	E	93	Very high	70.9	Confident	35 Å²	35	75.5 Å²	75.5	16%	0.164	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	127.6	174	-63.6	174.6	-145.7	0	0	109.6	T35 P37 Y77 P79 L135 R145	T35-E133 WeakPolarHBondContact OG1-CA 3.18Å; P37-E133 HydrophobicContact CG-CB 4.06Å; P37-E133 HydrophobicContact CG-CG 3.93Å; Y77-E133 WeakPolarHBondContact CB-O 3.23Å; Y77-E133 HydrophobicContact CD1-CB 4.4Å; Y77-E133 PolarHBondContact N-O 2.89Å; Y77-E133 PolarHBondContact O-N 2.84Å; P79-E133 HydrophobicContact CG-CG 4.08Å; P79-E133 WeakPolarHBondContact CG-OE1 3.46Å; E133-L135 HydrophobicContact CB-CD1 4.2Å; E133-L135 HydrophobicContact CB-CD2 4.11Å; E133-L135 HydrophobicContact CB-CG 3.78Å; E133-L135 PolarHBondContact O-N 3.09Å; E133-R145 IonicContact OE1-NH2 2.74Å; E133-R145 IonicContact OE2-NH2 3.86Å
134	L	93.3	Very high	71.9	Confident	2 Å²	2	70.8 Å²	70.8	1%	0.01	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	99	169.9	-178.6	62.8	0	0	0	108.7	I34 T35 V36 R57 I61 L66 F71 H74 L76	I34-L134 HydrophobicContact CG2-CB 4.37Å; T35-L134 PolarHBondContact O-N 3.03Å; V36-L134 HydrophobicContact CG2-CB 4.42Å; V36-L134 HydrophobicContact CG2-CD2 4.36Å; R57-L134 HydrophobicContact CG-CD1 3.93Å; I61-L134 HydrophobicContact CG1-CD2 4.21Å; L66-L134 HydrophobicContact CD1-CD2 3.99Å; F71-L134 HydrophobicContact CD1-CD2 3.88Å; F71-L134 HydrophobicContact CD1-CG 4.28Å; F71-L134 HydrophobicContact CE1-CD2 4.23Å; H74-L134 HydrophobicContact CB-CD1 3.88Å; H74-L134 HydrophobicContact CB-CG 4.33Å; L76-L134 HydrophobicContact CD2-CB 4.49Å; L76-L134 HydrophobicContact CD2-CD1 4.16Å
135	L	91.1	Very high	72.9	Confident	30 Å²	30	71 Å²	71	16%	0.157	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	150.7	-173.5	-64.4	-175.3	0	0	0	112.5	P37 H74 G75 Y77 F88 E133	P37-L135 HydrophobicContact CG-CD2 4.03Å; H74-L135 CarbonylContact C-O 3.6Å; H74-L135 WeakPolarHBondContact CA-O 3.47Å; H74-L135 WeakPolarHBondContact CB-O 3.42Å; G75-L135 PolarHBondContact N-O 3.37Å; G75-L135 PolarHBondContact O-N 3Å; G75-L135 VanDerWaalsContact O-N 3.1Å; Y77-L135 HydrophobicContact CD1-CD1 3.72Å; Y77-L135 HydrophobicContact CD2-CD1 4.48Å; Y77-L135 HydrophobicContact CE1-CD1 4.41Å; Y77-L135 HydrophobicContact CG-CD1 3.77Å; F88-L135 HydrophobicContact CE1-CB 3.93Å; F88-L135 HydrophobicContact CZ-CB 3.99Å; E133-L135 HydrophobicContact CB-CD1 4.2Å; E133-L135 HydrophobicContact CB-CD2 4.11Å; E133-L135 HydrophobicContact CB-CG 3.78Å; E133-L135 PolarHBondContact O-N 3.09Å
136	P	90	Very high	73.8	Confident	49 Å²	49	65.8 Å²	65.8	32%	0.318	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.3	140.6	168.3	28.4	-34.6	0	0	0	110.4	F88 I138	F88-P136 WeakPolarHBondContact CZ-O 3.17Å; P136-I138 HydrophobicContact CB-CG2 4.42Å; P136-I138 HydrophobicContact CG-CG2 4.39Å; P136-I138 PolarHBondContact O-N 2.89Å
137	K	90.4	Very high	74.2	Confident	10 Å²	10	68.5 Å²	68.5	4%	0.043	33%	0.328	C	S	.	.			trans	-72.8	71.5	-179.9	-69	-180	177.4	-175.2	0	111.7	N73 F88 N188 H221 D223 Y224	N73-K137 WeakPolarHBondContact O-CB 3.33Å; N73-K137 WeakPolarHBondContact O-CG 3Å; N73-K137 PolarHBondContact O-N 3.42Å; F88-K137 HydrophobicContact CE1-CG 4.48Å; K137-N188 WeakPolarHBondContact O-CB 3.46Å; K137-H221 PolarHBondContact O-CD2 3.33Å; K137-D223 IonicContact NZ-OD1 3.61Å; K137-D223 PolarHBondContact NZ-OD1 2.66Å; K137-D223 IonicContact NZ-OD2 3.03Å; K137-D223 PolarHBondContact NZ-OD2 3.23Å; K137-Y224 HydrophobicContact CB-CD2 4.12Å; K137-Y224 HydrophobicContact CB-CE2 4.39Å
138	I	85	Confident	74.2	Confident	77 Å²	77	64.7 Å²	64.7	40%	0.395	33%	0.328	S	S	.	.			trans	-88.2	163.6	174.1	60.2	172.1	0	0	0	111.6	P136 F140 D186 H221	P136-I138 HydrophobicContact CB-CG2 4.42Å; P136-I138 HydrophobicContact CG-CG2 4.39Å; P136-I138 PolarHBondContact O-N 2.89Å; I138-F140 PolarHBondContact O-N 3.33Å; I138-D186 WeakPolarHBondContact CA-OD2 3.3Å; I138-D186 WeakPolarHBondContact CB-OD2 3.2Å; I138-H221 PolarHBondContact O-NE2 2.99Å
139	R	83.1	Confident	73.8	Confident	37 Å²	37	57.8 Å²	57.8	14%	0.14	30%	0.299	C	S	.	.			trans	-64.2	112	167.5	177.8	-174.6	-176.3	179	2.9	109.2	V141 L181 L185 D186 N188 A218	R139-V141 HydrophobicContact CG-CG2 4.02Å; R139-V141 PolarHBondContact O-N 2.98Å; R139-L181 PolarHBondContact NH1-O 2.8Å; R139-L181 PolarHBondContact NH2-O 2.92Å; R139-L185 PolarHBondContact NH1-O 3.15Å; R139-D186 HydrophobicContact CB-CB 4.21Å; R139-D186 VanDerWaalsContact CB-CG 3.45Å; R139-D186 WeakPolarHBondContact CB-OD1 3.46Å; R139-D186 VanDerWaalsContact N-CG 3.31Å; R139-D186 PolarHBondContact N-OD1 2.85Å; R139-D186 PolarHBondContact N-OD2 3.27Å; R139-N188 PolarHBondContact N-ND2 2.84Å; R139-A218 WeakPolarHBondContact CD-O 3.23Å; R139-A218 WeakPolarHBondContact CG-O 3.38Å; R139-A218 PolarHBondContact NE-O 2.99Å
140	F	67.3	Low	73	Confident	51 Å²	51	60.8 Å²	60.8	22%	0.224	31%	0.309	C	S	.	.			trans	-72.8	112.5	-179.7	-153.4	-87.5	0	0	0	110.9	Y77 I138 E142 R470	Y77-F140 HydrophobicContact CE1-CE2 4.31Å; Y77-F140 AromaticContact CE2-CD2 3.94Å; Y77-F140 HydrophobicContact CE2-CD2 3.94Å; Y77-F140 AromaticContact CE2-CE2 3.63Å; Y77-F140 HydrophobicContact CE2-CE2 3.63Å; Y77-F140 HydrophobicContact CE2-CZ 4.27Å; Y77-F140 AromaticContact CZ-CE2 3.48Å; Y77-F140 VanDerWaalsContact CZ-CE2 3.48Å; Y77-F140 AromaticContact CZ-CZ 3.78Å; Y77-F140 VanDerWaalsContact OH-CE2 3.23Å; Y77-F140 WeakPolarHBondContact OH-CE2 3.39Å; Y77-F140 WeakPolarHBondContact OH-CZ 3.49Å; I138-F140 PolarHBondContact O-N 3.33Å; F140-E142 HydrophobicContact CD1-CG 4.49Å; F140-E142 HydrophobicContact CE1-CG 3.99Å; F140-R470 PolarHBondContact O-NH1 2.84Å; F140-R470 PolarHBondContact O-NH2 3.39Å
141	V	63.6	Low	72.2	Confident	33 Å²	33	63.6 Å²	63.6	20%	0.2	33%	0.33	C	S	.	.			trans	-130.3	123.7	171.4	-171.2	0	0	0	0	107.3	R139 E143 Y144	R139-V141 HydrophobicContact CG-CG2 4.02Å; R139-V141 PolarHBondContact O-N 2.98Å; V141-E143 HydrophobicContact CG1-CB 4.09Å; V141-E143 HydrophobicContact CG1-CG 4.2Å; V141-E143 PolarHBondContact O-N 2.77Å; V141-Y144 HydrophobicContact CB-CD1 4.48Å; V141-Y144 HydrophobicContact CB-CD2 3.87Å; V141-Y144 HydrophobicContact CB-CE1 4.4Å; V141-Y144 HydrophobicContact CB-CE2 3.78Å; V141-Y144 HydrophobicContact CB-CG 4.22Å; V141-Y144 HydrophobicContact CG2-CD2 4.26Å; V141-Y144 HydrophobicContact CG2-CE2 3.69Å; V141-Y144 PolarHBondContact O-N 2.96Å; V141-Y144 VanDerWaalsContact O-N 3.12Å
142	E	54.2	Low	71.5	Confident	115 Å²	115	66.1 Å²	66.1	54%	0.537	34%	0.34	S	S	.	.	G	3₁₀ helix	trans	-63.5	-28.7	-173.4	-72.6	164.8	115.9	0	0	112.1	K85 F140 Y144 R145	K85-E142 IonicContact NZ-OE1 2.76Å; K85-E142 IonicContact NZ-OE2 3.19Å; K85-E142 PolarHBondContact NZ-OE2 3Å; F140-E142 HydrophobicContact CD1-CG 4.49Å; F140-E142 HydrophobicContact CE1-CG 3.99Å; E142-Y144 PolarHBondContact O-N 3.23Å; E142-R145 PolarHBondContact O-N 3.19Å; E142-R145 VanDerWaalsContact O-N 3.16Å
143	E	50.3	Low	70.6	Confident	125 Å²	125	67.5 Å²	67.5	58%	0.584	35%	0.349	S	S	*	.	G	3₁₀ helix	trans	-60.4	-22.4	175.1	-57.3	-176.4	145.9	0	0	114.5	V141 R145 L146 S149	V141-E143 HydrophobicContact CG1-CB 4.09Å; V141-E143 HydrophobicContact CG1-CG 4.2Å; V141-E143 PolarHBondContact O-N 2.77Å; E143-R145 PolarHBondContact O-N 3.06Å; E143-L146 VanDerWaalsContact O-CB 3.31Å; E143-L146 WeakPolarHBondContact O-CB 3.45Å; E143-L146 PolarHBondContact O-N 2.82Å; E143-S149 VanDerWaalsContact O-CB 3.28Å; E143-S149 WeakPolarHBondContact O-CB 3.37Å; E143-S149 PolarHBondContact O-OG 3.06Å
144	Y	53.2	Low	70	Confident	50 Å²	50	73.5 Å²	73.5	20%	0.196	37%	0.374	C	S	.	.	G	3₁₀ helix	trans	-73.3	-11.4	178.1	-62.8	-21.5	0	0	0	113.5	V141 E142 L146 T153 G184	V141-Y144 HydrophobicContact CB-CD1 4.48Å; V141-Y144 HydrophobicContact CB-CD2 3.87Å; V141-Y144 HydrophobicContact CB-CE1 4.4Å; V141-Y144 HydrophobicContact CB-CE2 3.78Å; V141-Y144 HydrophobicContact CB-CG 4.22Å; V141-Y144 HydrophobicContact CG2-CD2 4.26Å; V141-Y144 HydrophobicContact CG2-CE2 3.69Å; V141-Y144 PolarHBondContact O-N 2.96Å; V141-Y144 VanDerWaalsContact O-N 3.12Å; E142-Y144 PolarHBondContact O-N 3.23Å; Y144-L146 VanDerWaalsContact C-N 3.33Å; Y144-T153 HydrophobicContact CD1-CG2 3.99Å; Y144-T153 WeakPolarHBondContact CD1-OG1 3.18Å; Y144-T153 HydrophobicContact CD2-CG2 4.46Å; Y144-T153 HydrophobicContact CE1-CG2 3.73Å; Y144-T153 VanDerWaalsContact CE1-OG1 3.25Å; Y144-T153 WeakPolarHBondContact CE1-OG1 3.21Å; Y144-T153 HydrophobicContact CE2-CG2 4.22Å; Y144-T153 HydrophobicContact CG-CG2 4.36Å; Y144-G184 PolarHBondContact OH-O 3.33Å
145	R	52.7	Low	69.6	Low	142 Å²	142	82.8 Å²	82.8	54%	0.536	41%	0.409	S	S	.	.	G	3₁₀ helix	trans	-79.8	-13.7	167.1	-77.4	-177.9	163.7	169.2	-6.5	112.8	E133 E142 E143	E133-R145 IonicContact OE1-NH2 2.74Å; E133-R145 IonicContact OE2-NH2 3.86Å; E142-R145 PolarHBondContact O-N 3.19Å; E142-R145 VanDerWaalsContact O-N 3.16Å; E143-R145 PolarHBondContact O-N 3.06Å
146	L	56.3	Low	69.5	Low	111 Å²	111	82.9 Å²	82.9	58%	0.581	41%	0.409	S	S	*	.	S	Bend	trans	-76.9	131.8	172.3	-57	172.8	0	0	0	110.4	E143 Y144 G148 S149	E143-L146 VanDerWaalsContact O-CB 3.31Å; E143-L146 WeakPolarHBondContact O-CB 3.45Å; E143-L146 PolarHBondContact O-N 2.82Å; Y144-L146 VanDerWaalsContact C-N 3.33Å; L146-G148 PolarHBondContact O-N 2.81Å; L146-S149 WeakPolarHBondContact O-CB 2.99Å; L146-S149 PolarHBondContact O-N 3.3Å; L146-S149 PolarHBondContact O-OG 2.83Å
147	E	52.9	Low	69.4	Low	146 Å²	146	82.3 Å²	82.3	68%	0.682	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.1	-34.4	-168.6	-57.7	-143.9	93.3	0	0	114.3	S149 K150	E147-S149 VanDerWaalsContact C-N 3.29Å; E147-S149 PolarHBondContact O-N 2.86Å; E147-K150 HydrophobicContact CB-CD 4.47Å; E147-K150 WeakPolarHBondContact O-CB 3.29Å; E147-K150 WeakPolarHBondContact O-CG 3.33Å; E147-K150 PolarHBondContact O-N 2.85Å; E147-K150 IonicContact OE1-NZ 2.63Å; E147-K150 PolarHBondContact OE1-NZ 2.86Å
148	G	58.6	Low	69.5	Low	60 Å²	60	83.7 Å²	83.7	62%	0.619	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.1	-33.6	175.6	0	0	0	0	0	113.2	L146 K150	L146-G148 PolarHBondContact O-N 2.81Å; G148-K150 PolarHBondContact O-N 2.76Å
149	S	61.7	Low	69.9	Low	26 Å²	26	86.2 Å²	86.2	18%	0.182	42%	0.423	C	S	.	.	H	α-helix	trans	-61.3	-33.2	178.9	-50.2	0	0	0	0	112.1	E143 L146 E147 S151 I152 T153	E143-S149 VanDerWaalsContact O-CB 3.28Å; E143-S149 WeakPolarHBondContact O-CB 3.37Å; E143-S149 PolarHBondContact O-OG 3.06Å; L146-S149 WeakPolarHBondContact O-CB 2.99Å; L146-S149 PolarHBondContact O-N 3.3Å; L146-S149 PolarHBondContact O-OG 2.83Å; E147-S149 VanDerWaalsContact C-N 3.29Å; E147-S149 PolarHBondContact O-N 2.86Å; S149-S151 PolarHBondContact O-N 3.18Å; S149-I152 WeakPolarHBondContact O-CA 3.41Å; S149-I152 PolarHBondContact O-N 3.32Å; S149-T153 PolarHBondContact O-N 2.86Å; S149-T153 PolarHBondContact O-OG1 2.83Å
150	K	66.4	Low	70.4	Confident	92 Å²	92	89.9 Å²	89.9	40%	0.4	44%	0.441	S	S	.	.	H	α-helix	trans	-50.9	-34.4	-174.2	-63.5	173.1	179.7	174.9	0	113.4	E147 G148 K154	E147-K150 HydrophobicContact CB-CD 4.47Å; E147-K150 WeakPolarHBondContact O-CB 3.29Å; E147-K150 WeakPolarHBondContact O-CG 3.33Å; E147-K150 PolarHBondContact O-N 2.85Å; E147-K150 IonicContact OE1-NZ 2.63Å; E147-K150 PolarHBondContact OE1-NZ 2.86Å; G148-K150 PolarHBondContact O-N 2.76Å; K150-K154 WeakPolarHBondContact O-CB 3.34Å; K150-K154 VanDerWaalsContact O-CD 3.31Å; K150-K154 WeakPolarHBondContact O-CD 3.37Å; K150-K154 WeakPolarHBondContact O-CG 3.41Å; K150-K154 PolarHBondContact O-N 2.87Å
151	S	68.6	Low	71.6	Confident	89 Å²	89	89.3 Å²	89.3	62%	0.622	44%	0.439	S	S	*	.	H	α-helix	trans	-81.4	-33.9	178.2	-66.7	0	0	0	0	113.4	S149 R155	S149-S151 PolarHBondContact O-N 3.18Å; S151-R155 PolarHBondContact O-N 2.92Å
152	I	75.6	Confident	73.2	Confident	109 Å²	109	88.9 Å²	88.9	56%	0.559	44%	0.435	S	S	*	.	H	α-helix	trans	-71.1	-50.2	176.7	-68.3	166.2	0	0	0	109.3	S149 K154 R155 I156	S149-I152 WeakPolarHBondContact O-CA 3.41Å; S149-I152 PolarHBondContact O-N 3.32Å; I152-K154 VanDerWaalsContact C-N 3.28Å; I152-K154 PolarHBondContact O-N 3.38Å; I152-R155 WeakPolarHBondContact O-CB 3.26Å; I152-R155 PolarHBondContact O-N 3.06Å; I152-I156 HydrophobicContact CG2-CD1 3.54Å; I152-I156 HydrophobicContact CG2-CG1 4.42Å; I152-I156 WeakPolarHBondContact O-CD1 3.21Å; I152-I156 WeakPolarHBondContact O-CG1 3.42Å; I152-I156 PolarHBondContact O-N 3.33Å
153	T	75.8	Confident	75.2	Confident	28 Å²	28	89.2 Å²	89.2	17%	0.172	44%	0.435	C	S	.	.	H	α-helix	trans	-53	-43.4	174.8	-49.2	0	0	0	0	111.8	Y144 S149 R155 I156 N157	Y144-T153 HydrophobicContact CD1-CG2 3.99Å; Y144-T153 WeakPolarHBondContact CD1-OG1 3.18Å; Y144-T153 HydrophobicContact CD2-CG2 4.46Å; Y144-T153 HydrophobicContact CE1-CG2 3.73Å; Y144-T153 VanDerWaalsContact CE1-OG1 3.25Å; Y144-T153 WeakPolarHBondContact CE1-OG1 3.21Å; Y144-T153 HydrophobicContact CE2-CG2 4.22Å; Y144-T153 HydrophobicContact CG-CG2 4.36Å; S149-T153 PolarHBondContact O-N 2.86Å; S149-T153 PolarHBondContact O-OG1 2.83Å; T153-R155 VanDerWaalsContact C-N 3.34Å; T153-R155 PolarHBondContact O-N 3.28Å; T153-I156 PolarHBondContact O-N 2.84Å; T153-N157 VanDerWaalsContact O-CB 3.3Å; T153-N157 WeakPolarHBondContact O-CB 3.4Å; T153-N157 PolarHBondContact O-N 2.82Å; T153-N157 PolarHBondContact O-ND2 2.72Å
154	K	80.7	Confident	77.4	Confident	162 Å²	162	89.4 Å²	89.4	70%	0.704	43%	0.43	S	S	*	.	H	α-helix	trans	-66.2	-28.8	176.7	-77.4	172	-175	176.8	0	114.1	K150 I152	K150-K154 WeakPolarHBondContact O-CB 3.34Å; K150-K154 VanDerWaalsContact O-CD 3.31Å; K150-K154 WeakPolarHBondContact O-CD 3.37Å; K150-K154 WeakPolarHBondContact O-CG 3.41Å; K150-K154 PolarHBondContact O-N 2.87Å; I152-K154 VanDerWaalsContact C-N 3.28Å; I152-K154 PolarHBondContact O-N 3.38Å
155	R	85.1	Confident	79.5	Confident	197 Å²	197	87 Å²	87	74%	0.743	42%	0.421	S	S	*	.	H	α-helix	trans	-77.4	-44.4	176.6	-173.7	-174.7	-66.4	-177.6	-1.6	111.1	S151 I152 T153 S158 H161	S151-R155 PolarHBondContact O-N 2.92Å; I152-R155 WeakPolarHBondContact O-CB 3.26Å; I152-R155 PolarHBondContact O-N 3.06Å; T153-R155 VanDerWaalsContact C-N 3.34Å; T153-R155 PolarHBondContact O-N 3.28Å; R155-S158 WeakPolarHBondContact O-CB 3.28Å; R155-S158 PolarHBondContact O-OG 2.94Å; R155-S158 VanDerWaalsContact O-OG 3.13Å; R155-H161 PolarHBondContact O-CE1 2.78Å; R155-H161 PolarHBondContact O-ND1 3.49Å; R155-H161 VanDerWaalsContact O-ND1 3.11Å
156	I	87.4	Confident	81.6	Confident	31 Å²	31	80.9 Å²	80.9	16%	0.159	40%	0.398	C	S	.	.	H	α-helix	trans	-63.3	-51	176.6	-59.5	151.7	0	0	0	109.3	I152 T153 S158 H161 Q183 L185	I152-I156 HydrophobicContact CG2-CD1 3.54Å; I152-I156 HydrophobicContact CG2-CG1 4.42Å; I152-I156 WeakPolarHBondContact O-CD1 3.21Å; I152-I156 WeakPolarHBondContact O-CG1 3.42Å; I152-I156 PolarHBondContact O-N 3.33Å; T153-I156 PolarHBondContact O-N 2.84Å; I156-S158 PolarHBondContact O-N 3.02Å; I156-H161 WeakPolarHBondContact O-CB 3.07Å; I156-H161 VanDerWaalsContact O-CG 3.28Å; I156-H161 PolarHBondContact O-ND1 3.31Å; I156-Q183 WeakPolarHBondContact CD1-O 3.33Å; I156-L185 HydrophobicContact CG2-CB 4.03Å; I156-L185 HydrophobicContact CG2-CD1 4.35Å
157	N	88.4	Confident	83.5	Confident	38 Å²	38	77.7 Å²	77.7	20%	0.203	39%	0.386	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.9	36.7	-178.7	-65.5	-83.7	0	0	0	113.9	T153 G184 D186	T153-N157 VanDerWaalsContact O-CB 3.3Å; T153-N157 WeakPolarHBondContact O-CB 3.4Å; T153-N157 PolarHBondContact O-N 2.82Å; T153-N157 PolarHBondContact O-ND2 2.72Å; N157-G184 PolarHBondContact ND2-O 3Å; N157-D186 WeakPolarHBondContact OD1-CB 3.16Å; N157-D186 PolarHBondContact OD1-N 3.06Å
158	S	92.5	Very high	85.7	Confident	38 Å²	38	71 Å²	71	27%	0.266	36%	0.355	S	S	.	.	S	Bend	trans	-84.1	155.9	176.5	68.7	0	0	0	0	112.3	R155 I156 H160 H161 Q162	R155-S158 WeakPolarHBondContact O-CB 3.28Å; R155-S158 PolarHBondContact O-OG 2.94Å; R155-S158 VanDerWaalsContact O-OG 3.13Å; I156-S158 PolarHBondContact O-N 3.02Å; S158-H160 PolarHBondContact O-N 3.18Å; S158-H161 PolarHBondContact O-N 3.28Å; S158-H161 PolarHBondContact OG-ND1 3.06Å; S158-Q162 WeakPolarHBondContact O-CG 3.47Å; S158-Q162 PolarHBondContact O-N 3.34Å
159	K	92.9	Very high	87.5	Confident	130 Å²	130	68.1 Å²	68.1	57%	0.565	33%	0.326	S	S	*	.	H	α-helix	trans	-48.9	-32.1	176.4	-65	-179.5	-177.9	174.9	0	112.7	K163 P192	K159-K163 WeakPolarHBondContact O-CB 3.5Å; K159-K163 PolarHBondContact O-N 3.24Å; K159-P192 HydrophobicContact CG-CG 4.35Å
160	H	93.7	Very high	89.2	Confident	114 Å²	114	71.3 Å²	71.3	53%	0.528	34%	0.336	S	S	.	.	H	α-helix	trans	-67.6	-50.7	177.4	178.2	87.9	0	0	0	112.9	S158 K163 R164	S158-H160 PolarHBondContact O-N 3.18Å; H160-K163 PolarHBondContact O-N 2.91Å; H160-R164 WeakPolarHBondContact NE2-CD 3.23Å; H160-R164 PolarHBondContact O-N 3.38Å
161	H	94.1	Very high	90.6	Very high	39 Å²	39	76 Å²	76	18%	0.181	35%	0.351	C	S	.	.	H	α-helix	trans	-69.6	-36.1	178.7	-61.5	124.7	0	0	0	111.9	R155 I156 S158 K163 R164 L165 L185	R155-H161 PolarHBondContact O-CE1 2.78Å; R155-H161 PolarHBondContact O-ND1 3.49Å; R155-H161 VanDerWaalsContact O-ND1 3.11Å; I156-H161 WeakPolarHBondContact O-CB 3.07Å; I156-H161 VanDerWaalsContact O-CG 3.28Å; I156-H161 PolarHBondContact O-ND1 3.31Å; S158-H161 PolarHBondContact O-N 3.28Å; S158-H161 PolarHBondContact OG-ND1 3.06Å; H161-K163 PolarHBondContact O-N 3.13Å; H161-R164 PolarHBondContact O-N 2.67Å; H161-R164 VanDerWaalsContact O-N 3.14Å; H161-L165 PolarHBondContact O-N 2.93Å; H161-L185 HydrophobicContact CB-CD1 4.16Å; H161-L185 HydrophobicContact CB-CD2 4.39Å
162	Q	95.8	Very high	91.9	Very high	24 Å²	24	74.9 Å²	74.9	11%	0.112	34%	0.338	C	S	.	.	H	α-helix	trans	-56.4	-47.2	170.5	-71.4	178	-24.7	0	0	111.8	S158 R164 L165 L166 F189 Y191	S158-Q162 WeakPolarHBondContact O-CG 3.47Å; S158-Q162 PolarHBondContact O-N 3.34Å; Q162-R164 VanDerWaalsContact C-N 3.34Å; Q162-R164 PolarHBondContact O-N 3.17Å; Q162-L165 PolarHBondContact O-N 3.47Å; Q162-L166 PolarHBondContact O-N 2.86Å; Q162-L166 VanDerWaalsContact O-N 3.13Å; Q162-F189 HydrophobicContact CB-CD2 4.07Å; Q162-F189 HydrophobicContact CB-CE1 4.25Å; Q162-F189 HydrophobicContact CB-CE2 3.56Å; Q162-F189 HydrophobicContact CB-CZ 3.65Å; Q162-F189 HydrophobicContact CG-CD1 3.95Å; Q162-F189 HydrophobicContact CG-CD2 3.88Å; Q162-F189 HydrophobicContact CG-CE1 3.84Å; Q162-F189 HydrophobicContact CG-CE2 3.79Å; Q162-F189 HydrophobicContact CG-CG 3.97Å; Q162-F189 HydrophobicContact CG-CZ 3.77Å; Q162-Y191 HydrophobicContact CB-CD2 4.12Å; Q162-Y191 HydrophobicContact CB-CE2 4.42Å
163	K	96.4	Very high	92.9	Very high	122 Å²	122	71.4 Å²	71.4	53%	0.53	32%	0.321	S	S	.	.	H	α-helix	trans	-61.7	-40.4	174.1	-168.9	-179	-177.2	179.5	0	111.9	K159 H160 H161 S167 Y191	K159-K163 WeakPolarHBondContact O-CB 3.5Å; K159-K163 PolarHBondContact O-N 3.24Å; H160-K163 PolarHBondContact O-N 2.91Å; H161-K163 PolarHBondContact O-N 3.13Å; K163-S167 VanDerWaalsContact O-CB 3.31Å; K163-S167 WeakPolarHBondContact O-CB 3.21Å; K163-S167 PolarHBondContact O-N 2.71Å; K163-S167 PolarHBondContact O-OG 2.9Å; K163-Y191 HydrophobicContact CB-CE2 3.83Å; K163-Y191 HydrophobicContact CG-CE2 4.45Å
164	R	96.7	Very high	93.9	Very high	129 Å²	129	72.7 Å²	72.7	49%	0.487	33%	0.326	S	S	.	.	H	α-helix	trans	-64.6	-42	177.2	-77.2	178.8	60.1	172.3	-1.9	112.6	H160 H161 Q162 S167 A168 L180	H160-R164 WeakPolarHBondContact NE2-CD 3.23Å; H160-R164 PolarHBondContact O-N 3.38Å; H161-R164 PolarHBondContact O-N 2.67Å; H161-R164 VanDerWaalsContact O-N 3.14Å; Q162-R164 VanDerWaalsContact C-N 3.34Å; Q162-R164 PolarHBondContact O-N 3.17Å; R164-S167 PolarHBondContact O-N 3.49Å; R164-A168 PolarHBondContact O-N 3.37Å; R164-L180 HydrophobicContact CB-CD1 4.13Å
165	L	97.2	Very high	94.6	Very high	0 Å²	0	67 Å²	67	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-60.7	-51.3	175.9	-176.7	72.4	0	0	0	110.8	H161 Q162 S167 A168 I169 V177 L180 L181 L185 F189 P198	H161-L165 PolarHBondContact O-N 2.93Å; Q162-L165 PolarHBondContact O-N 3.47Å; L165-S167 VanDerWaalsContact C-N 3.26Å; L165-S167 PolarHBondContact O-N 3.06Å; L165-A168 PolarHBondContact O-N 2.91Å; L165-I169 HydrophobicContact CD2-CD1 4.43Å; L165-I169 HydrophobicContact CG-CD1 3.94Å; L165-I169 WeakPolarHBondContact O-CG1 3.31Å; L165-I169 PolarHBondContact O-N 3.12Å; L165-V177 HydrophobicContact CD1-CB 4.38Å; L165-V177 HydrophobicContact CD1-CG1 4.07Å; L165-V177 HydrophobicContact CD1-CG2 4.18Å; L165-L180 HydrophobicContact CB-CD1 4.13Å; L165-L180 HydrophobicContact CD1-CB 4.19Å; L165-L180 HydrophobicContact CD1-CD1 4.27Å; L165-L181 HydrophobicContact CD1-CD2 4.36Å; L165-L181 HydrophobicContact CD1-CG 4.26Å; L165-L181 HydrophobicContact CD2-CD2 4.46Å; L165-L185 HydrophobicContact CB-CD2 3.66Å; L165-L185 HydrophobicContact CD1-CD2 4.27Å; L165-L185 HydrophobicContact CD2-CD2 3.8Å; L165-L185 HydrophobicContact CD2-CG 4.45Å; L165-L185 HydrophobicContact CG-CD2 4.1Å; L165-F189 HydrophobicContact CD2-CE1 3.86Å; L165-F189 HydrophobicContact CD2-CZ 4.1Å; L165-P198 HydrophobicContact CD2-CB 4.31Å; L165-P198 HydrophobicContact CD2-CG 3.99Å
166	L	97.2	Very high	95.2	Very high	13 Å²	13	64.6 Å²	64.6	7%	0.068	30%	0.304	C	S	.	.	H	α-helix	trans	-60.9	-35.1	175.9	-69.4	177	0	0	0	112.6	Q162 A168 I169 K170 F189 Y191 V196 P198 C201	Q162-L166 PolarHBondContact O-N 2.86Å; Q162-L166 VanDerWaalsContact O-N 3.13Å; L166-A168 VanDerWaalsContact C-N 3.31Å; L166-A168 PolarHBondContact O-N 3.17Å; L166-I169 HydrophobicContact CD2-CD1 4.35Å; L166-I169 PolarHBondContact O-N 2.83Å; L166-K170 WeakPolarHBondContact O-CB 3.4Å; L166-K170 WeakPolarHBondContact O-CG 3.41Å; L166-K170 PolarHBondContact O-N 3.07Å; L166-F189 HydrophobicContact CD1-CE2 4.08Å; L166-F189 HydrophobicContact CG-CE2 4.26Å; L166-F189 HydrophobicContact CG-CZ 4.31Å; L166-Y191 HydrophobicContact CD1-CD1 4.23Å; L166-Y191 HydrophobicContact CD1-CD2 4.11Å; L166-Y191 HydrophobicContact CD1-CG 3.69Å; L166-V196 HydrophobicContact CD1-CG2 3.77Å; L166-V196 HydrophobicContact CD2-CG2 4.4Å; L166-P198 HydrophobicContact CD2-CB 4.46Å; L166-P198 HydrophobicContact CD2-CG 4.13Å; L166-C201 HydrophobicContact CD2-CB 3.81Å
167	S	96.7	Very high	95.7	Very high	45 Å²	45	63.1 Å²	63.1	32%	0.315	30%	0.297	S	S	.	.	H	α-helix	trans	-70.6	-25.4	175.9	-56.2	0	0	0	0	113.3	K163 R164 L165 R171	K163-S167 VanDerWaalsContact O-CB 3.31Å; K163-S167 WeakPolarHBondContact O-CB 3.21Å; K163-S167 PolarHBondContact O-N 2.71Å; K163-S167 PolarHBondContact O-OG 2.9Å; R164-S167 PolarHBondContact O-N 3.49Å; L165-S167 VanDerWaalsContact C-N 3.26Å; L165-S167 PolarHBondContact O-N 3.06Å; S167-R171 VanDerWaalsContact O-CD 3.23Å; S167-R171 WeakPolarHBondContact O-CD 3.46Å; S167-R171 VanDerWaalsContact O-CG 3.25Å; S167-R171 WeakPolarHBondContact O-CG 3.27Å
168	A	97.5	Very high	96	Very high	5 Å²	5	63 Å²	63	4%	0.041	30%	0.297	C	S	.	.	H	α-helix	trans	-80.4	-43.2	172.9	0	0	0	0	0	110.7	R164 L165 L166 R171 D172 D173 R176 V177	R164-A168 PolarHBondContact O-N 3.37Å; L165-A168 PolarHBondContact O-N 2.91Å; L166-A168 VanDerWaalsContact C-N 3.31Å; L166-A168 PolarHBondContact O-N 3.17Å; A168-R171 CarbonylContact O-C 3.52Å; A168-R171 PolarHBondContact O-N 3.22Å; A168-D172 PolarHBondContact O-N 3.09Å; A168-D173 HydrophobicContact CB-CB 4.2Å; A168-D173 PolarHBondContact O-N 3.37Å; A168-R176 HydrophobicContact CB-CB 4.08Å; A168-V177 HydrophobicContact CB-CG2 3.66Å
169	I	97.7	Very high	96.2	Very high	0 Å²	0	65.5 Å²	65.5	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-57.7	-51.3	173.5	-63.2	163.3	0	0	0	110.5	L165 L166 R171 D172 V177 P198 C201 A202 L205 M211 L215	L165-I169 HydrophobicContact CD2-CD1 4.43Å; L165-I169 HydrophobicContact CG-CD1 3.94Å; L165-I169 WeakPolarHBondContact O-CG1 3.31Å; L165-I169 PolarHBondContact O-N 3.12Å; L166-I169 HydrophobicContact CD2-CD1 4.35Å; L166-I169 PolarHBondContact O-N 2.83Å; I169-R171 PolarHBondContact O-N 2.98Å; I169-D172 PolarHBondContact O-N 3.02Å; I169-V177 HydrophobicContact CG1-CG2 3.79Å; I169-P198 HydrophobicContact CD1-CB 3.74Å; I169-C201 HydrophobicContact CG2-CB 4Å; I169-A202 HydrophobicContact CG2-CB 4.14Å; I169-L205 HydrophobicContact CG2-CD1 4.18Å; I169-L205 WeakPolarHBondContact O-CD2 3.09Å; I169-M211 HydrophobicContact CB-SD 4.46Å; I169-M211 HydrophobicContact CG1-SD 3.92Å; I169-M211 HydrophobicContact CG2-CG 4.19Å; I169-M211 HydrophobicContact CG2-SD 4.44Å; I169-L215 HydrophobicContact CD1-CD1 3.99Å; I169-L215 HydrophobicContact CD1-CD2 4.09Å; I169-L215 HydrophobicContact CG1-CD1 4.42Å
170	K	96.2	Very high	96.2	Very high	92 Å²	92	59.7 Å²	59.7	40%	0.4	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-6.2	176.1	-75.2	-153.7	179.2	-159.9	0	114.9	L166 C201 D719	L166-K170 WeakPolarHBondContact O-CB 3.4Å; L166-K170 WeakPolarHBondContact O-CG 3.41Å; L166-K170 PolarHBondContact O-N 3.07Å; K170-C201 WeakPolarHBondContact CG-SG 3.18Å; K170-D719 IonicContact NZ-OD1 2.65Å; K170-D719 PolarHBondContact NZ-OD1 3.21Å; K170-D719 IonicContact NZ-OD2 3.06Å; K170-D719 PolarHBondContact NZ-OD2 3.14Å
171	R	96.5	Very high	96.2	Very high	191 Å²	191	54.6 Å²	54.6	72%	0.721	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-115.1	3.7	177.3	-68.3	175.3	-179	173.6	-2.7	113.2	S167 A168 I169 D173	S167-R171 VanDerWaalsContact O-CD 3.23Å; S167-R171 WeakPolarHBondContact O-CD 3.46Å; S167-R171 VanDerWaalsContact O-CG 3.25Å; S167-R171 WeakPolarHBondContact O-CG 3.27Å; A168-R171 CarbonylContact O-C 3.52Å; A168-R171 PolarHBondContact O-N 3.22Å; I169-R171 PolarHBondContact O-N 2.98Å; R171-D173 HydrophobicContact CB-CB 4.37Å; R171-D173 PolarHBondContact O-N 3.1Å
172	D	96.4	Very high	96	Very high	65 Å²	65	60.2 Å²	60.2	35%	0.348	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.7	31.4	-170.4	-149.4	15.3	0	0	0	114.1	A168 I169 I174 M211	A168-D172 PolarHBondContact O-N 3.09Å; I169-D172 PolarHBondContact O-N 3.02Å; D172-I174 VanDerWaalsContact C-N 3.3Å; D172-I174 PolarHBondContact O-N 2.68Å; D172-M211 WeakPolarHBondContact OD1-CE 3.31Å
173	D	96.8	Very high	95.7	Very high	37 Å²	37	64.1 Å²	64.1	20%	0.198	30%	0.304	C	S	.	.			trans	-84.7	73.7	-176.8	-169.6	-21.3	0	0	0	110.5	A168 R171 G175 R176 V177	A168-D173 HydrophobicContact CB-CB 4.2Å; A168-D173 PolarHBondContact O-N 3.37Å; R171-D173 HydrophobicContact CB-CB 4.37Å; R171-D173 PolarHBondContact O-N 3.1Å; D173-G175 PolarHBondContact O-N 3.49Å; D173-R176 HydrophobicContact CB-CB 4.44Å; D173-R176 PolarHBondContact O-N 3.48Å; D173-R176 WeakPolarHBondContact OD1-CB 3.14Å; D173-R176 WeakPolarHBondContact OD1-CG 3.42Å; D173-R176 PolarHBondContact OD1-N 3.38Å; D173-R176 WeakPolarHBondContact OD2-CD 3.5Å; D173-R176 WeakPolarHBondContact OD2-CG 3.33Å; D173-R176 IonicContact OD2-CZ 2.62Å; D173-R176 IonicContact OD2-NE 2.84Å; D173-R176 IonicContact OD2-NH1 2.75Å; D173-R176 PolarHBondContact OD2-NH1 3.19Å; D173-V177 WeakPolarHBondContact O-CG2 3.49Å; D173-V177 PolarHBondContact O-N 2.95Å
174	I	95.5	Very high	95.3	Very high	54 Å²	54	59 Å²	59	28%	0.277	29%	0.286	S	S	.	.	H	α-helix	trans	-53.7	-39.3	-178.8	-62.3	161.9	0	0	0	111.1	D172 V177 T178 E210 M211 Q214	D172-I174 VanDerWaalsContact C-N 3.3Å; D172-I174 PolarHBondContact O-N 2.68Å; I174-V177 PolarHBondContact O-N 3.07Å; I174-T178 PolarHBondContact O-N 3.1Å; I174-T178 PolarHBondContact O-OG1 2.88Å; I174-E210 HydrophobicContact CD1-CB 3.97Å; I174-E210 HydrophobicContact CD1-CG 3.85Å; I174-E210 HydrophobicContact CG2-CG 4.47Å; I174-M211 HydrophobicContact CG1-CE 3.8Å; I174-Q214 HydrophobicContact CG2-CG 4.08Å
175	G	96.6	Very high	95.1	Very high	42 Å²	42	52.9 Å²	52.9	43%	0.433	26%	0.263	S	S	.	.	H	α-helix	trans	-59.9	-53.9	178.5	0	0	0	0	0	112.5	D173 V177 T178 D179	D173-G175 PolarHBondContact O-N 3.49Å; G175-V177 PolarHBondContact O-N 2.92Å; G175-T178 PolarHBondContact O-N 3.14Å; G175-D179 PolarHBondContact O-N 2.67Å
176	R	96.8	Very high	94.8	Very high	148 Å²	148	53.6 Å²	53.6	56%	0.558	27%	0.267	S	S	*	.	H	α-helix	trans	-68.4	-23.5	177.6	-67.9	-169.8	179.9	106.6	0.3	113.4	A168 D173 L180	A168-R176 HydrophobicContact CB-CB 4.08Å; D173-R176 HydrophobicContact CB-CB 4.44Å; D173-R176 PolarHBondContact O-N 3.48Å; D173-R176 WeakPolarHBondContact OD1-CB 3.14Å; D173-R176 WeakPolarHBondContact OD1-CG 3.42Å; D173-R176 PolarHBondContact OD1-N 3.38Å; D173-R176 WeakPolarHBondContact OD2-CD 3.5Å; D173-R176 WeakPolarHBondContact OD2-CG 3.33Å; D173-R176 IonicContact OD2-CZ 2.62Å; D173-R176 IonicContact OD2-NE 2.84Å; D173-R176 IonicContact OD2-NH1 2.75Å; D173-R176 PolarHBondContact OD2-NH1 3.19Å; R176-L180 WeakPolarHBondContact O-CD1 3.29Å; R176-L180 VanDerWaalsContact O-CG 3.27Å; R176-L180 WeakPolarHBondContact O-CG 3.35Å; R176-L180 PolarHBondContact O-N 2.97Å
177	V	97.3	Very high	94.7	Very high	0 Å²	0	53.2 Å²	53.2	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-68.5	-49.5	170.5	167.3	0	0	0	0	110.2	L165 A168 I169 D173 I174 G175 L180 L181 M211 L215	L165-V177 HydrophobicContact CD1-CB 4.38Å; L165-V177 HydrophobicContact CD1-CG1 4.07Å; L165-V177 HydrophobicContact CD1-CG2 4.18Å; A168-V177 HydrophobicContact CB-CG2 3.66Å; I169-V177 HydrophobicContact CG1-CG2 3.79Å; D173-V177 WeakPolarHBondContact O-CG2 3.49Å; D173-V177 PolarHBondContact O-N 2.95Å; I174-V177 PolarHBondContact O-N 3.07Å; G175-V177 PolarHBondContact O-N 2.92Å; V177-L180 PolarHBondContact O-N 2.93Å; V177-L181 HydrophobicContact CG1-CD1 3.51Å; V177-L181 HydrophobicContact CG1-CG 4.38Å; V177-L181 VanDerWaalsContact O-CG 3.23Å; V177-L181 WeakPolarHBondContact O-CG 3.32Å; V177-L181 PolarHBondContact O-N 2.74Å; V177-M211 HydrophobicContact CB-SD 4.16Å; V177-M211 HydrophobicContact CG1-SD 3.92Å; V177-M211 HydrophobicContact CG2-CE 4.06Å; V177-M211 HydrophobicContact CG2-SD 3.79Å; V177-L215 HydrophobicContact CG1-CD2 4.35Å
178	T	96.3	Very high	94.6	Very high	35 Å²	35	51.6 Å²	51.6	22%	0.215	25%	0.253	C	S	.	.	H	α-helix	trans	-57.7	-49.5	174.6	-60.4	0	0	0	0	111.5	I174 G175 L180 L181 E182	I174-T178 PolarHBondContact O-N 3.1Å; I174-T178 PolarHBondContact O-OG1 2.88Å; G175-T178 PolarHBondContact O-N 3.14Å; T178-L180 VanDerWaalsContact C-N 3.26Å; T178-L180 PolarHBondContact O-N 2.97Å; T178-L181 PolarHBondContact O-N 3.24Å; T178-E182 HydrophobicContact CG2-CG 4.08Å; T178-E182 PolarHBondContact O-N 3.4Å
179	D	95.1	Very high	94.5	Very high	91 Å²	91	52 Å²	52	49%	0.487	25%	0.253	S	S	.	.	H	α-helix	trans	-50.2	-45.3	177.4	-71.2	-23.2	0	0	0	112.4	G175 Q183	G175-D179 PolarHBondContact O-N 2.67Å; D179-Q183 VanDerWaalsContact O-CG 3.3Å; D179-Q183 WeakPolarHBondContact O-CG 3.47Å; D179-Q183 PolarHBondContact O-N 2.88Å; D179-Q183 PolarHBondContact O-NE2 2.78Å
180	L	94.3	Very high	94.4	Very high	7 Å²	7	55.1 Å²	55.1	4%	0.037	27%	0.268	C	S	.	.	H	α-helix	trans	-74.1	-34.5	-178.1	-72.2	170.3	0	0	0	112.3	R164 L165 R176 V177 T178 L185	R164-L180 HydrophobicContact CB-CD1 4.13Å; L165-L180 HydrophobicContact CB-CD1 4.13Å; L165-L180 HydrophobicContact CD1-CB 4.19Å; L165-L180 HydrophobicContact CD1-CD1 4.27Å; R176-L180 WeakPolarHBondContact O-CD1 3.29Å; R176-L180 VanDerWaalsContact O-CG 3.27Å; R176-L180 WeakPolarHBondContact O-CG 3.35Å; R176-L180 PolarHBondContact O-N 2.97Å; V177-L180 PolarHBondContact O-N 2.93Å; T178-L180 VanDerWaalsContact C-N 3.26Å; T178-L180 PolarHBondContact O-N 2.97Å; L180-L185 HydrophobicContact CB-CD2 4.1Å; L180-L185 WeakPolarHBondContact O-CB 3.1Å; L180-L185 PolarHBondContact O-N 2.79Å
181	L	93.1	Very high	94.3	Very high	7 Å²	7	52.5 Å²	52.5	4%	0.037	26%	0.256	C	S	.	.	H	α-helix	trans	-77	-33.3	178.6	-65.7	168	0	0	0	111.9	R139 L165 V177 T178 Q183 G184 P187 L215 A218	R139-L181 PolarHBondContact NH1-O 2.8Å; R139-L181 PolarHBondContact NH2-O 2.92Å; L165-L181 HydrophobicContact CD1-CD2 4.36Å; L165-L181 HydrophobicContact CD1-CG 4.26Å; L165-L181 HydrophobicContact CD2-CD2 4.46Å; V177-L181 HydrophobicContact CG1-CD1 3.51Å; V177-L181 HydrophobicContact CG1-CG 4.38Å; V177-L181 VanDerWaalsContact O-CG 3.23Å; V177-L181 WeakPolarHBondContact O-CG 3.32Å; V177-L181 PolarHBondContact O-N 2.74Å; T178-L181 PolarHBondContact O-N 3.24Å; L181-Q183 VanDerWaalsContact C-N 3.34Å; L181-G184 PolarHBondContact O-N 3.23Å; L181-P187 HydrophobicContact CD2-CB 4.1Å; L181-P187 HydrophobicContact CD2-CG 4.25Å; L181-L215 HydrophobicContact CD1-CD2 4.06Å; L181-A218 HydrophobicContact CB-CB 3.85Å; L181-A218 HydrophobicContact CD1-CB 3.71Å; L181-A218 HydrophobicContact CD2-CB 3.85Å; L181-A218 HydrophobicContact CG-CB 4Å
182	E	90.6	Very high	94	Very high	157 Å²	157	47.5 Å²	47.5	73%	0.734	25%	0.248	S	C	*	.	H	α-helix	trans	-68.7	-33.1	171.7	-71.2	-170.1	173.4	0	0	111.9	T178 G184	T178-E182 HydrophobicContact CG2-CG 4.08Å; T178-E182 PolarHBondContact O-N 3.4Å; E182-G184 PolarHBondContact O-N 2.66Å
183	Q	88.8	Confident	93.7	Very high	107 Å²	107	49.1 Å²	49.1	50%	0.5	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63	-3.6	169.7	-79.8	167.1	73.9	0	0	114.7	I156 D179 L181	I156-Q183 WeakPolarHBondContact CD1-O 3.33Å; D179-Q183 VanDerWaalsContact O-CG 3.3Å; D179-Q183 WeakPolarHBondContact O-CG 3.47Å; D179-Q183 PolarHBondContact O-N 2.88Å; D179-Q183 PolarHBondContact O-NE2 2.78Å; L181-Q183 VanDerWaalsContact C-N 3.34Å
184	G	87.7	Confident	93.5	Very high	14 Å²	14	49.3 Å²	49.3	14%	0.144	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	86.3	21.9	-179.6	0	0	0	0	0	114.6	Y144 N157 L181 E182	Y144-G184 PolarHBondContact OH-O 3.33Å; N157-G184 PolarHBondContact ND2-O 3Å; L181-G184 PolarHBondContact O-N 3.23Å; E182-G184 PolarHBondContact O-N 2.66Å
185	L	92.1	Very high	93.4	Very high	1 Å²	1	47.2 Å²	47.2	1%	0.005	26%	0.26	C	S	.	.			trans	-66.7	134.1	167	-171.3	60.8	0	0	0	109.5	R139 I156 H161 L165 L180	R139-L185 PolarHBondContact NH1-O 3.15Å; I156-L185 HydrophobicContact CG2-CB 4.03Å; I156-L185 HydrophobicContact CG2-CD1 4.35Å; H161-L185 HydrophobicContact CB-CD1 4.16Å; H161-L185 HydrophobicContact CB-CD2 4.39Å; L165-L185 HydrophobicContact CB-CD2 3.66Å; L165-L185 HydrophobicContact CD1-CD2 4.27Å; L165-L185 HydrophobicContact CD2-CD2 3.8Å; L165-L185 HydrophobicContact CD2-CG 4.45Å; L165-L185 HydrophobicContact CG-CD2 4.1Å; L180-L185 HydrophobicContact CB-CD2 4.1Å; L180-L185 WeakPolarHBondContact O-CB 3.1Å; L180-L185 PolarHBondContact O-N 2.79Å
186	D	92.2	Very high	93.3	Very high	15 Å²	15	46.8 Å²	46.8	8%	0.08	25%	0.249	C	C	.	.			trans	-82.4	123.3	171.7	-166.6	-18.8	0	0	0	108.6	I138 R139 N157 N188 F189	I138-D186 WeakPolarHBondContact CA-OD2 3.3Å; I138-D186 WeakPolarHBondContact CB-OD2 3.2Å; R139-D186 HydrophobicContact CB-CB 4.21Å; R139-D186 VanDerWaalsContact CB-CG 3.45Å; R139-D186 WeakPolarHBondContact CB-OD1 3.46Å; R139-D186 VanDerWaalsContact N-CG 3.31Å; R139-D186 PolarHBondContact N-OD1 2.85Å; R139-D186 PolarHBondContact N-OD2 3.27Å; N157-D186 WeakPolarHBondContact OD1-CB 3.16Å; N157-D186 PolarHBondContact OD1-N 3.06Å; D186-N188 PolarHBondContact O-N 3.18Å; D186-N188 WeakPolarHBondContact OD1-CB 3.49Å; D186-N188 PolarHBondContact OD1-N 3.11Å; D186-N188 PolarHBondContact OD1-ND2 3.2Å; D186-F189 WeakPolarHBondContact O-CD1 3.48Å; D186-F189 WeakPolarHBondContact O-CE1 3.48Å
187	P	95	Very high	93.2	Very high	4 Å²	4	39.9 Å²	39.9	3%	0.026	22%	0.223	C	C	.	.	S	Bend	trans	-74.6	-4.7	172.5	30.5	-35.2	0	0	0	113.5	L181 F189 P198 L215 A220	L181-P187 HydrophobicContact CD2-CB 4.1Å; L181-P187 HydrophobicContact CD2-CG 4.25Å; P187-F189 PolarHBondContact O-N 2.77Å; P187-P198 VanDerWaalsContact O-CD 3.28Å; P187-P198 WeakPolarHBondContact O-CD 3.13Å; P187-P198 WeakPolarHBondContact O-CG 3.35Å; P187-L215 HydrophobicContact CB-CD2 4.04Å; P187-A220 HydrophobicContact CB-CB 3.89Å; P187-A220 HydrophobicContact CG-CB 3.67Å
188	N	95	Very high	93.2	Very high	12 Å²	12	40 Å²	40	6%	0.064	22%	0.224	C	C	.	.			trans	-94.3	69.3	-175.5	-57.6	-75.2	0	0	0	112.6	K137 R139 D186 G219 A220 H221 Y224	K137-N188 WeakPolarHBondContact O-CB 3.46Å; R139-N188 PolarHBondContact N-ND2 2.84Å; D186-N188 PolarHBondContact O-N 3.18Å; D186-N188 WeakPolarHBondContact OD1-CB 3.49Å; D186-N188 PolarHBondContact OD1-N 3.11Å; D186-N188 PolarHBondContact OD1-ND2 3.2Å; N188-G219 PolarHBondContact ND2-O 3.2Å; N188-A220 WeakPolarHBondContact OD1-CA 3.49Å; N188-H221 PolarHBondContact OD1-CD2 3.28Å; N188-H221 VanDerWaalsContact OD1-CD2 3.23Å; N188-H221 PolarHBondContact OD1-N 2.87Å; N188-Y224 VanDerWaalsContact C-CZ 3.48Å; N188-Y224 HydrophobicContact CB-CD2 3.83Å; N188-Y224 HydrophobicContact CB-CE2 3.65Å; N188-Y224 PolarHBondContact O-OH 3.29Å
189	F	94.2	Very high	93.3	Very high	12 Å²	12	38.6 Å²	38.6	5%	0.053	22%	0.215	C	C	.	.			trans	-137	148.8	174.1	62.8	-89.2	0	0	0	112.6	Q162 L165 L166 D186 P187 Y191 I197 P198 Y224	Q162-F189 HydrophobicContact CB-CD2 4.07Å; Q162-F189 HydrophobicContact CB-CE1 4.25Å; Q162-F189 HydrophobicContact CB-CE2 3.56Å; Q162-F189 HydrophobicContact CB-CZ 3.65Å; Q162-F189 HydrophobicContact CG-CD1 3.95Å; Q162-F189 HydrophobicContact CG-CD2 3.88Å; Q162-F189 HydrophobicContact CG-CE1 3.84Å; Q162-F189 HydrophobicContact CG-CE2 3.79Å; Q162-F189 HydrophobicContact CG-CG 3.97Å; Q162-F189 HydrophobicContact CG-CZ 3.77Å; L165-F189 HydrophobicContact CD2-CE1 3.86Å; L165-F189 HydrophobicContact CD2-CZ 4.1Å; L166-F189 HydrophobicContact CD1-CE2 4.08Å; L166-F189 HydrophobicContact CG-CE2 4.26Å; L166-F189 HydrophobicContact CG-CZ 4.31Å; D186-F189 WeakPolarHBondContact O-CD1 3.48Å; D186-F189 WeakPolarHBondContact O-CE1 3.48Å; P187-F189 PolarHBondContact O-N 2.77Å; F189-Y191 HydrophobicContact CE2-CD2 4.43Å; F189-I197 WeakPolarHBondContact O-CA 3.4Å; F189-I197 WeakPolarHBondContact O-CG2 3.32Å; F189-P198 HydrophobicContact CD1-CG 4.19Å; F189-P198 HydrophobicContact CE1-CG 3.56Å; F189-P198 HydrophobicContact CE2-CG 4.13Å; F189-P198 HydrophobicContact CZ-CG 3.52Å; F189-P198 WeakPolarHBondContact O-CD 3.27Å; F189-Y224 WeakPolarHBondContact CA-OH 3.35Å
190	Q	95	Very high	93.4	Very high	66 Å²	66	34.4 Å²	34.4	31%	0.308	19%	0.194	S	C	.	.			trans	-85.7	128.2	158	-60.8	-179	-6.1	0	0	108.6	N73 I197 Y224 R225 D226	N73-Q190 PolarHBondContact ND2-NE2 3.1Å; Q190-I197 HydrophobicContact CG-CG2 3.91Å; Q190-Y224 HydrophobicContact CG-CE1 4.13Å; Q190-R225 PolarHBondContact NE2-O 3.18Å; Q190-D226 PolarHBondContact NE2-O 2.83Å
191	Y	95	Very high	93.5	Very high	38 Å²	38	34.1 Å²	34.1	15%	0.149	19%	0.192	C	C	.	.			trans	-76.6	122.7	-178.6	-177.6	-110.5	0	0	0	111.5	Q162 K163 L166 F189 S193 S194 G195 V196	Q162-Y191 HydrophobicContact CB-CD2 4.12Å; Q162-Y191 HydrophobicContact CB-CE2 4.42Å; K163-Y191 HydrophobicContact CB-CE2 3.83Å; K163-Y191 HydrophobicContact CG-CE2 4.45Å; L166-Y191 HydrophobicContact CD1-CD1 4.23Å; L166-Y191 HydrophobicContact CD1-CD2 4.11Å; L166-Y191 HydrophobicContact CD1-CG 3.69Å; F189-Y191 HydrophobicContact CE2-CD2 4.43Å; Y191-S193 VanDerWaalsContact C-N 3.26Å; Y191-S193 WeakPolarHBondContact CE1-OG 3.3Å; Y191-S193 PolarHBondContact O-N 3.06Å; Y191-S194 PolarHBondContact O-N 3.21Å; Y191-S194 VanDerWaalsContact O-N 3.17Å; Y191-G195 WeakPolarHBondContact O-CA 3.45Å; Y191-G195 PolarHBondContact O-N 3Å; Y191-V196 PolarHBondContact N-O 3.01Å
192	P	90.7	Very high	93.7	Very high	85 Å²	85	33.8 Å²	33.8	55%	0.552	19%	0.191	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.2	-17.5	-159.8	-31.1	37.2	0	0	0	118.8	K159	K159-P192 HydrophobicContact CG-CG 4.35Å
193	S	90	Very high	94	Very high	99 Å²	99	26.3 Å²	26.3	69%	0.692	16%	0.156	S	C	*	.	T	Hydrogen-bonded Turn	trans	-103.3	-13.6	-179.1	70	0	0	0	0	115.1	Y191	Y191-S193 VanDerWaalsContact C-N 3.26Å; Y191-S193 WeakPolarHBondContact CE1-OG 3.3Å; Y191-S193 PolarHBondContact O-N 3.06Å
194	S	91.8	Very high	94.2	Very high	42 Å²	42	25.7 Å²	25.7	29%	0.294	15%	0.153	S	C	.	.	T	Hydrogen-bonded Turn	trans	-134.5	-5.5	-180	60.7	0	0	0	0	113.9	Y191 V196	Y191-S194 PolarHBondContact O-N 3.21Å; Y191-S194 VanDerWaalsContact O-N 3.17Å; S194-V196 PolarHBondContact O-N 2.87Å
195	G	93.4	Very high	94.7	Very high	9 Å²	9	26 Å²	26	9%	0.093	15%	0.151	C	C	.	.			trans	71.6	-11.6	177	0	0	0	0	0	116	Y191 D226 S227	Y191-G195 WeakPolarHBondContact O-CA 3.45Å; Y191-G195 PolarHBondContact O-N 3Å; G195-D226 WeakPolarHBondContact O-CB 3.42Å; G195-S227 WeakPolarHBondContact CA-OG 3.26Å; G195-S227 PolarHBondContact O-N 3.05Å
196	V	94.3	Very high	94.7	Very high	34 Å²	34	30.2 Å²	30.2	21%	0.206	19%	0.186	C	C	.	.			trans	-60.3	150.6	-178.2	-52.8	0	0	0	0	112.3	L166 Y191 S194	L166-V196 HydrophobicContact CD1-CG2 3.77Å; L166-V196 HydrophobicContact CD2-CG2 4.4Å; Y191-V196 PolarHBondContact N-O 3.01Å; S194-V196 PolarHBondContact O-N 2.87Å
197	I	96.3	Very high	94.9	Very high	3 Å²	3	33.9 Å²	33.9	2%	0.015	21%	0.205	C	C	.	.			trans	-115.6	148	-179.4	65.8	178	0	0	0	109.7	F189 Q190 L199 G200 C201 Y224 D226	F189-I197 WeakPolarHBondContact O-CA 3.4Å; F189-I197 WeakPolarHBondContact O-CG2 3.32Å; Q190-I197 HydrophobicContact CG-CG2 3.91Å; I197-L199 PolarHBondContact O-N 3.24Å; I197-G200 WeakPolarHBondContact O-CA 3.35Å; I197-G200 PolarHBondContact O-N 2.97Å; I197-C201 PolarHBondContact O-N 2.7Å; I197-Y224 HydrophobicContact CB-CD1 4.27Å; I197-Y224 HydrophobicContact CD1-CD1 4.2Å; I197-Y224 WeakPolarHBondContact CD1-O 3.48Å; I197-Y224 HydrophobicContact CG2-CD1 3.8Å; I197-Y224 HydrophobicContact CG2-CE1 3.82Å; I197-D226 HydrophobicContact CG1-CB 4.43Å; I197-D226 HydrophobicContact CG2-CB 3.9Å
198	P	97.1	Very high	95	Very high	1 Å²	1	33.7 Å²	33.7	1%	0.006	20%	0.204	C	C	.	.	H	α-helix	trans	-50.7	-44	-178.1	-35.4	40.8	0	0	0	115.9	L165 L166 I169 P187 F189 G200 C201 A202 L215	L165-P198 HydrophobicContact CD2-CB 4.31Å; L165-P198 HydrophobicContact CD2-CG 3.99Å; L166-P198 HydrophobicContact CD2-CB 4.46Å; L166-P198 HydrophobicContact CD2-CG 4.13Å; I169-P198 HydrophobicContact CD1-CB 3.74Å; P187-P198 VanDerWaalsContact O-CD 3.28Å; P187-P198 WeakPolarHBondContact O-CD 3.13Å; P187-P198 WeakPolarHBondContact O-CG 3.35Å; F189-P198 HydrophobicContact CD1-CG 4.19Å; F189-P198 HydrophobicContact CE1-CG 3.56Å; F189-P198 HydrophobicContact CE2-CG 4.13Å; F189-P198 HydrophobicContact CZ-CG 3.52Å; F189-P198 WeakPolarHBondContact O-CD 3.27Å; P198-G200 PolarHBondContact O-N 2.83Å; P198-C201 WeakPolarHBondContact O-CB 3.28Å; P198-C201 PolarHBondContact O-N 3.43Å; P198-A202 PolarHBondContact O-N 3.37Å; P198-L215 HydrophobicContact CB-CD1 4.4Å; P198-L215 HydrophobicContact CB-CD2 4.02Å
199	L	97.4	Very high	95.1	Very high	6 Å²	6	38.3 Å²	38.3	3%	0.031	22%	0.221	C	C	.	.	H	α-helix	trans	-67.9	-32.5	176.5	-68.4	178.6	0	0	0	113.3	I197 A202 A203 L215 V216 A220 L222 A232 F248	I197-L199 PolarHBondContact O-N 3.24Å; L199-A202 PolarHBondContact O-N 3.41Å; L199-A203 PolarHBondContact O-N 3.39Å; L199-A203 VanDerWaalsContact O-N 3.12Å; L199-L215 HydrophobicContact CD2-CB 3.62Å; L199-L215 HydrophobicContact CD2-CD1 4.02Å; L199-L215 HydrophobicContact CD2-CG 4.46Å; L199-V216 HydrophobicContact CD1-CG2 4.42Å; L199-V216 HydrophobicContact CD2-CG2 3.94Å; L199-A220 HydrophobicContact CD1-CB 3.71Å; L199-A220 HydrophobicContact CD2-CB 4.02Å; L199-A220 HydrophobicContact CG-CB 3.82Å; L199-L222 HydrophobicContact CD1-CD2 4.45Å; L199-A232 HydrophobicContact CB-CB 3.66Å; L199-F248 HydrophobicContact CD2-CE1 4.48Å
200	G	96.6	Very high	95.2	Very high	4 Å²	4	41.8 Å²	41.8	4%	0.041	24%	0.237	C	C	.	.	H	α-helix	trans	-68.6	-40.5	174.2	0	0	0	0	0	111.4	I197 P198 A202 A203	I197-G200 WeakPolarHBondContact O-CA 3.35Å; I197-G200 PolarHBondContact O-N 2.97Å; P198-G200 PolarHBondContact O-N 2.83Å; G200-A202 VanDerWaalsContact C-N 3.31Å; G200-A202 PolarHBondContact O-N 2.98Å; G200-A203 VanDerWaalsContact O-CB 3.3Å; G200-A203 WeakPolarHBondContact O-CB 3.39Å; G200-A203 PolarHBondContact O-N 2.9Å; G200-A203 VanDerWaalsContact O-N 3.12Å
201	C	96.6	Very high	95.3	Very high	1 Å²	1	38.7 Å²	38.7	1%	0.007	22%	0.223	C	C	.	.	H	α-helix	trans	-64.6	-33.4	172.3	-169.4	0	0	0	0	112.5	L166 I169 K170 I197 P198 A203 E204	L166-C201 HydrophobicContact CD2-CB 3.81Å; I169-C201 HydrophobicContact CG2-CB 4Å; K170-C201 WeakPolarHBondContact CG-SG 3.18Å; I197-C201 PolarHBondContact O-N 2.7Å; P198-C201 WeakPolarHBondContact O-CB 3.28Å; P198-C201 PolarHBondContact O-N 3.43Å; C201-A203 VanDerWaalsContact C-N 3.31Å; C201-E204 PolarHBondContact O-N 2.76Å
202	A	97.5	Very high	95.5	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-69.7	-27.4	173	0	0	0	0	0	112.5	I169 P198 L199 G200 E204 L205 P208 M211 I212 L215	I169-A202 HydrophobicContact CG2-CB 4.14Å; P198-A202 PolarHBondContact O-N 3.37Å; L199-A202 PolarHBondContact O-N 3.41Å; G200-A202 VanDerWaalsContact C-N 3.31Å; G200-A202 PolarHBondContact O-N 2.98Å; A202-E204 PolarHBondContact O-N 2.76Å; A202-L205 WeakPolarHBondContact O-CB 3.2Å; A202-L205 PolarHBondContact O-N 3.17Å; A202-P208 VanDerWaalsContact O-CB 3.27Å; A202-P208 WeakPolarHBondContact O-CB 3.14Å; A202-M211 HydrophobicContact CB-CG 3.89Å; A202-I212 HydrophobicContact CB-CG1 4Å; A202-L215 HydrophobicContact CB-CD1 3.91Å
203	A	96.5	Very high	95.8	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.1	-9.8	175.6	0	0	0	0	0	114.2	L199 G200 C201 R235 A236 N239 N241 A244 F248	L199-A203 PolarHBondContact O-N 3.39Å; L199-A203 VanDerWaalsContact O-N 3.12Å; G200-A203 VanDerWaalsContact O-CB 3.3Å; G200-A203 WeakPolarHBondContact O-CB 3.39Å; G200-A203 PolarHBondContact O-N 2.9Å; G200-A203 VanDerWaalsContact O-N 3.12Å; C201-A203 VanDerWaalsContact C-N 3.31Å; A203-R235 HydrophobicContact CB-CB 4.36Å; A203-A236 HydrophobicContact CB-CB 4.04Å; A203-N239 PolarHBondContact O-ND2 2.99Å; A203-N241 PolarHBondContact O-ND2 2.95Å; A203-A244 HydrophobicContact CB-CB 4.26Å; A203-F248 HydrophobicContact CB-CE2 3.9Å; A203-F248 HydrophobicContact CB-CZ 4.31Å
204	E	94.8	Very high	96	Very high	94 Å²	94	32.1 Å²	32.1	44%	0.439	18%	0.176	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.8	-9.7	173.2	-68.2	165.1	-154.4	0	0	112.8	C201 A202 N239	C201-E204 PolarHBondContact O-N 2.76Å; A202-E204 PolarHBondContact O-N 2.76Å; E204-N239 VanDerWaalsContact CG-ND2 3.34Å; E204-N239 WeakPolarHBondContact CG-ND2 3.31Å
205	L	96.5	Very high	96.3	Very high	20 Å²	20	30.1 Å²	30.1	11%	0.105	16%	0.162	C	C	.	.	S	Bend	trans	-83.8	149	-173	-57.2	176.5	0	0	0	113.8	I169 A202 P208 M211 N241	I169-L205 HydrophobicContact CG2-CD1 4.18Å; I169-L205 WeakPolarHBondContact O-CD2 3.09Å; A202-L205 WeakPolarHBondContact O-CB 3.2Å; A202-L205 PolarHBondContact O-N 3.17Å; L205-P208 HydrophobicContact CB-CB 4.19Å; L205-P208 WeakPolarHBondContact O-CD 3.3Å; L205-M211 HydrophobicContact CD1-CB 3.95Å; L205-M211 HydrophobicContact CD1-CE 4.38Å; L205-M211 HydrophobicContact CD1-CG 3.72Å; L205-N241 PolarHBondContact O-ND2 3.11Å
206	A	93.9	Very high	96.3	Very high	90 Å²	90	30 Å²	30	74%	0.744	16%	0.16	S	C	*	.	S	Bend	trans	-74.7	-23.5	-177.5	0	0	0	0	0	114.4	K243	A206-K243 WeakPolarHBondContact O-CD 3.26Å; A206-K243 PolarHBondContact O-NZ 3.01Å
207	D	95.1	Very high	96.3	Very high	91 Å²	91	31.9 Å²	31.9	49%	0.487	17%	0.168	S	C	.	.	S	Bend	trans	-135.4	71	168.3	-157.7	31	0	0	0	111.8	R209 K243	D207-R209 PolarHBondContact O-N 3.49Å; D207-K243 VanDerWaalsContact CG-NZ 3.33Å; D207-K243 WeakPolarHBondContact OD1-CD 3.4Å; D207-K243 WeakPolarHBondContact OD1-CE 3.44Å; D207-K243 IonicContact OD1-NZ 2.72Å; D207-K243 PolarHBondContact OD1-NZ 2.98Å
208	P	96.7	Very high	96.1	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.6	-3.1	-162.3	33.8	-38.2	0	0	0	113.9	A202 L205 I212 K243 A244	A202-P208 VanDerWaalsContact O-CB 3.27Å; A202-P208 WeakPolarHBondContact O-CB 3.14Å; L205-P208 HydrophobicContact CB-CB 4.19Å; L205-P208 WeakPolarHBondContact O-CD 3.3Å; P208-I212 HydrophobicContact CB-CD1 3.82Å; P208-I212 HydrophobicContact CB-CG1 4.38Å; P208-I212 HydrophobicContact CG-CD1 4.33Å; P208-I212 WeakPolarHBondContact O-CB 3.41Å; P208-I212 WeakPolarHBondContact O-CD1 3.36Å; P208-I212 VanDerWaalsContact O-CG1 3.22Å; P208-I212 WeakPolarHBondContact O-CG1 3.35Å; P208-I212 PolarHBondContact O-N 3.24Å; P208-K243 HydrophobicContact CG-CB 3.86Å; P208-A244 HydrophobicContact CB-CB 4.36Å; P208-A244 HydrophobicContact CG-CB 3.83Å
209	R	97.4	Very high	95.8	Very high	110 Å²	110	33 Å²	33	42%	0.415	18%	0.18	S	C	.	.	H	α-helix	trans	-62.7	-53.3	-165.2	-173.4	164.4	-151.5	-77	-3.9	112.7	D207 L213 V247 E250	D207-R209 PolarHBondContact O-N 3.49Å; R209-L213 HydrophobicContact CG-CD1 4.1Å; R209-L213 VanDerWaalsContact O-CG 3.26Å; R209-L213 WeakPolarHBondContact O-CG 3.49Å; R209-L213 PolarHBondContact O-N 3.4Å; R209-V247 HydrophobicContact CB-CG2 3.89Å; R209-V247 HydrophobicContact CG-CG1 4.39Å; R209-V247 HydrophobicContact CG-CG2 3.61Å; R209-E250 IonicContact CZ-OE2 2.83Å; R209-E250 IonicContact NE-OE2 3.15Å; R209-E250 IonicContact NH2-OE2 3.85Å; R209-E250 PolarHBondContact NH2-OE2 3.06Å
210	E	96.7	Very high	95.6	Very high	85 Å²	85	33 Å²	33	40%	0.397	18%	0.181	S	C	.	.	H	α-helix	trans	-69.4	-41.1	-177.6	-169	57.5	-152.7	0	0	111.1	I174 I212 L213 Q214	I174-E210 HydrophobicContact CD1-CB 3.97Å; I174-E210 HydrophobicContact CD1-CG 3.85Å; I174-E210 HydrophobicContact CG2-CG 4.47Å; E210-I212 PolarHBondContact O-N 3.48Å; E210-L213 PolarHBondContact O-N 2.91Å; E210-Q214 HydrophobicContact CG-CG 4.46Å; E210-Q214 WeakPolarHBondContact O-CG 3.38Å; E210-Q214 PolarHBondContact O-N 3.35Å; E210-Q214 PolarHBondContact OE1-NE2 2.86Å
211	M	97.8	Very high	95.5	Very high	0 Å²	0	35 Å²	35	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-58.4	-45.5	175.8	-172.8	62.9	68.2	0	0	112.7	I169 D172 I174 V177 A202 L205 L215	I169-M211 HydrophobicContact CB-SD 4.46Å; I169-M211 HydrophobicContact CG1-SD 3.92Å; I169-M211 HydrophobicContact CG2-CG 4.19Å; I169-M211 HydrophobicContact CG2-SD 4.44Å; D172-M211 WeakPolarHBondContact OD1-CE 3.31Å; I174-M211 HydrophobicContact CG1-CE 3.8Å; V177-M211 HydrophobicContact CB-SD 4.16Å; V177-M211 HydrophobicContact CG1-SD 3.92Å; V177-M211 HydrophobicContact CG2-CE 4.06Å; V177-M211 HydrophobicContact CG2-SD 3.79Å; A202-M211 HydrophobicContact CB-CG 3.89Å; L205-M211 HydrophobicContact CD1-CB 3.95Å; L205-M211 HydrophobicContact CD1-CE 4.38Å; L205-M211 HydrophobicContact CD1-CG 3.72Å; M211-L215 HydrophobicContact CG-CD1 4.17Å; M211-L215 WeakPolarHBondContact O-CG 3.48Å; M211-L215 PolarHBondContact O-N 2.95Å; M211-L215 VanDerWaalsContact O-N 3.11Å; M211-L215 HydrophobicContact SD-CD1 4.47Å
212	I	97.9	Very high	95.3	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-62.3	-46.5	175	-69.8	165.9	0	0	0	110.1	A202 P208 E210 Q214 L215 V216 A244 V247 F248 L251	A202-I212 HydrophobicContact CB-CG1 4Å; P208-I212 HydrophobicContact CB-CD1 3.82Å; P208-I212 HydrophobicContact CB-CG1 4.38Å; P208-I212 HydrophobicContact CG-CD1 4.33Å; P208-I212 WeakPolarHBondContact O-CB 3.41Å; P208-I212 WeakPolarHBondContact O-CD1 3.36Å; P208-I212 VanDerWaalsContact O-CG1 3.22Å; P208-I212 WeakPolarHBondContact O-CG1 3.35Å; P208-I212 PolarHBondContact O-N 3.24Å; E210-I212 PolarHBondContact O-N 3.48Å; I212-Q214 PolarHBondContact O-N 3.11Å; I212-L215 PolarHBondContact O-N 3.34Å; I212-V216 HydrophobicContact CG2-CG2 4.1Å; I212-V216 WeakPolarHBondContact O-CB 3.34Å; I212-V216 VanDerWaalsContact O-CG2 3.25Å; I212-V216 WeakPolarHBondContact O-CG2 3.4Å; I212-V216 PolarHBondContact O-N 2.96Å; I212-A244 HydrophobicContact CD1-CB 4.29Å; I212-V247 HydrophobicContact CB-CG1 4.12Å; I212-V247 HydrophobicContact CD1-CB 4.38Å; I212-V247 HydrophobicContact CD1-CG1 4.2Å; I212-V247 HydrophobicContact CG2-CG1 3.84Å; I212-F248 HydrophobicContact CB-CE1 4.4Å; I212-F248 HydrophobicContact CD1-CD1 4.23Å; I212-F248 HydrophobicContact CD1-CD2 4.47Å; I212-F248 HydrophobicContact CD1-CE1 3.65Å; I212-F248 HydrophobicContact CD1-CE2 3.92Å; I212-F248 HydrophobicContact CD1-CZ 3.46Å; I212-F248 VanDerWaalsContact CD1-CZ 3.46Å; I212-F248 HydrophobicContact CG1-CE1 3.81Å; I212-F248 HydrophobicContact CG1-CZ 3.82Å; I212-F248 HydrophobicContact CG2-CD1 3.99Å; I212-F248 HydrophobicContact CG2-CE1 3.64Å; I212-F248 HydrophobicContact CG2-CZ 4.49Å; I212-L251 HydrophobicContact CG2-CD1 3.66Å
213	L	97	Very high	95	Very high	32 Å²	32	37.9 Å²	37.9	17%	0.168	20%	0.204	C	C	.	.	H	α-helix	trans	-60.4	-43.7	180	-72.6	170	0	0	0	112.1	R209 E210 V216 N217 L251	R209-L213 HydrophobicContact CG-CD1 4.1Å; R209-L213 VanDerWaalsContact O-CG 3.26Å; R209-L213 WeakPolarHBondContact O-CG 3.49Å; R209-L213 PolarHBondContact O-N 3.4Å; E210-L213 PolarHBondContact O-N 2.91Å; L213-V216 PolarHBondContact O-N 3.15Å; L213-N217 VanDerWaalsContact O-CB 3.24Å; L213-N217 WeakPolarHBondContact O-CB 3.49Å; L213-N217 PolarHBondContact O-N 2.88Å; L213-N217 PolarHBondContact O-ND2 2.68Å; L213-N217 VanDerWaalsContact O-ND2 3.13Å; L213-L251 HydrophobicContact CD2-CD1 4.22Å; L213-L251 HydrophobicContact CD2-CD2 3.92Å
214	Q	95.9	Very high	94.9	Very high	53 Å²	53	39.2 Å²	39.2	25%	0.248	21%	0.209	C	C	.	.	H	α-helix	trans	-65.6	-43.2	178.1	-65.8	-59.8	-20.5	0	0	112.3	I174 E210 I212 V216 A218	I174-Q214 HydrophobicContact CG2-CG 4.08Å; E210-Q214 HydrophobicContact CG-CG 4.46Å; E210-Q214 WeakPolarHBondContact O-CG 3.38Å; E210-Q214 PolarHBondContact O-N 3.35Å; E210-Q214 PolarHBondContact OE1-NE2 2.86Å; I212-Q214 PolarHBondContact O-N 3.11Å; Q214-V216 PolarHBondContact O-N 3.21Å; Q214-A218 WeakPolarHBondContact O-CB 3.45Å; Q214-A218 PolarHBondContact O-N 3Å
215	L	96.7	Very high	94.9	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-62.1	-42.6	175	-73.1	165.8	0	0	0	112.2	I169 V177 L181 P187 P198 L199 A202 M211 I212 A218 G219 A220	I169-L215 HydrophobicContact CD1-CD1 3.99Å; I169-L215 HydrophobicContact CD1-CD2 4.09Å; I169-L215 HydrophobicContact CG1-CD1 4.42Å; V177-L215 HydrophobicContact CG1-CD2 4.35Å; L181-L215 HydrophobicContact CD1-CD2 4.06Å; P187-L215 HydrophobicContact CB-CD2 4.04Å; P198-L215 HydrophobicContact CB-CD1 4.4Å; P198-L215 HydrophobicContact CB-CD2 4.02Å; L199-L215 HydrophobicContact CD2-CB 3.62Å; L199-L215 HydrophobicContact CD2-CD1 4.02Å; L199-L215 HydrophobicContact CD2-CG 4.46Å; A202-L215 HydrophobicContact CB-CD1 3.91Å; M211-L215 HydrophobicContact CG-CD1 4.17Å; M211-L215 WeakPolarHBondContact O-CG 3.48Å; M211-L215 PolarHBondContact O-N 2.95Å; M211-L215 VanDerWaalsContact O-N 3.11Å; M211-L215 HydrophobicContact SD-CD1 4.47Å; I212-L215 PolarHBondContact O-N 3.34Å; L215-A218 CarbonylContact O-C 3.52Å; L215-A218 PolarHBondContact O-N 2.91Å; L215-G219 PolarHBondContact O-N 3.25Å; L215-A220 HydrophobicContact CB-CB 4.28Å; L215-A220 WeakPolarHBondContact O-CB 3.1Å; L215-A220 PolarHBondContact O-N 3.04Å
216	V	94.9	Very high	94.8	Very high	7 Å²	7	35.7 Å²	35.7	4%	0.042	19%	0.191	C	C	.	.	H	α-helix	trans	-71.4	-40.2	-179.9	170.7	0	0	0	0	111.7	L199 I212 L213 Q214 A218 G219 L222 L251 M466	L199-V216 HydrophobicContact CD1-CG2 4.42Å; L199-V216 HydrophobicContact CD2-CG2 3.94Å; I212-V216 HydrophobicContact CG2-CG2 4.1Å; I212-V216 WeakPolarHBondContact O-CB 3.34Å; I212-V216 VanDerWaalsContact O-CG2 3.25Å; I212-V216 WeakPolarHBondContact O-CG2 3.4Å; I212-V216 PolarHBondContact O-N 2.96Å; L213-V216 PolarHBondContact O-N 3.15Å; Q214-V216 PolarHBondContact O-N 3.21Å; V216-A218 VanDerWaalsContact C-N 3.28Å; V216-A218 PolarHBondContact O-N 3.48Å; V216-G219 WeakPolarHBondContact O-CA 3.25Å; V216-G219 PolarHBondContact O-N 3.24Å; V216-L222 HydrophobicContact CG2-CD2 3.72Å; V216-L251 HydrophobicContact CG2-CD1 4.26Å; V216-M466 HydrophobicContact CG1-CE 3.24Å
217	N	92.9	Very high	94.8	Very high	72 Å²	72	34.2 Å²	34.2	39%	0.385	18%	0.175	S	C	.	.	H	α-helix	trans	-63.1	-34.4	172.6	-72.6	-27	0	0	0	111.9	L213 G219	L213-N217 VanDerWaalsContact O-CB 3.24Å; L213-N217 WeakPolarHBondContact O-CB 3.49Å; L213-N217 PolarHBondContact O-N 2.88Å; L213-N217 PolarHBondContact O-ND2 2.68Å; L213-N217 VanDerWaalsContact O-ND2 3.13Å; N217-G219 PolarHBondContact O-N 2.97Å
218	A	91.7	Very high	94.6	Very high	12 Å²	12	32.5 Å²	32.5	10%	0.099	17%	0.166	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.3	3.7	169.5	0	0	0	0	0	114	R139 L181 Q214 L215 V216	R139-A218 WeakPolarHBondContact CD-O 3.23Å; R139-A218 WeakPolarHBondContact CG-O 3.38Å; R139-A218 PolarHBondContact NE-O 2.99Å; L181-A218 HydrophobicContact CB-CB 3.85Å; L181-A218 HydrophobicContact CD1-CB 3.71Å; L181-A218 HydrophobicContact CD2-CB 3.85Å; L181-A218 HydrophobicContact CG-CB 4Å; Q214-A218 WeakPolarHBondContact O-CB 3.45Å; Q214-A218 PolarHBondContact O-N 3Å; L215-A218 CarbonylContact O-C 3.52Å; L215-A218 PolarHBondContact O-N 2.91Å; V216-A218 VanDerWaalsContact C-N 3.28Å; V216-A218 PolarHBondContact O-N 3.48Å
219	G	90.8	Very high	94.4	Very high	16 Å²	16	33 Å²	33	17%	0.165	17%	0.169	C	C	.	.	T	Hydrogen-bonded Turn	trans	89.2	28.3	173.3	0	0	0	0	0	115.1	N188 L215 V216 N217	N188-G219 PolarHBondContact ND2-O 3.2Å; L215-G219 PolarHBondContact O-N 3.25Å; V216-G219 WeakPolarHBondContact O-CA 3.25Å; V216-G219 PolarHBondContact O-N 3.24Å; N217-G219 PolarHBondContact O-N 2.97Å
220	A	94.9	Very high	94.3	Very high	7 Å²	7	28.3 Å²	28.3	6%	0.058	15%	0.152	C	C	.	.			trans	-70.3	126.9	166.8	0	0	0	0	0	111.2	P187 N188 L199 L215	P187-A220 HydrophobicContact CB-CB 3.89Å; P187-A220 HydrophobicContact CG-CB 3.67Å; N188-A220 WeakPolarHBondContact OD1-CA 3.49Å; L199-A220 HydrophobicContact CD1-CB 3.71Å; L199-A220 HydrophobicContact CD2-CB 4.02Å; L199-A220 HydrophobicContact CG-CB 3.82Å; L215-A220 HydrophobicContact CB-CB 4.28Å; L215-A220 WeakPolarHBondContact O-CB 3.1Å; L215-A220 PolarHBondContact O-N 3.04Å
221	H	92.9	Very high	94.2	Very high	44 Å²	44	24.3 Å²	24.3	20%	0.204	13%	0.133	C	C	.	.			trans	-78.7	122	176.9	-61.3	-77.5	0	0	0	110	F88 K137 I138 N188 D223 Y224	F88-H221 AromaticContact CD2-CE1 3.9Å; K137-H221 PolarHBondContact O-CD2 3.33Å; I138-H221 PolarHBondContact O-NE2 2.99Å; N188-H221 PolarHBondContact OD1-CD2 3.28Å; N188-H221 VanDerWaalsContact OD1-CD2 3.23Å; N188-H221 PolarHBondContact OD1-N 2.87Å; H221-D223 PolarHBondContact O-N 2.66Å; H221-Y224 WeakPolarHBondContact O-CB 3.4Å; H221-Y224 PolarHBondContact O-N 3.37Å
222	L	92.9	Very high	94.2	Very high	27 Å²	27	24.3 Å²	24.3	14%	0.141	13%	0.133	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.1	-34.1	-178	-64.6	170.3	0	0	0	113	L199 V216 Y224 F248 L251 Q253	L199-L222 HydrophobicContact CD1-CD2 4.45Å; V216-L222 HydrophobicContact CG2-CD2 3.72Å; L222-Y224 VanDerWaalsContact C-N 3.34Å; L222-F248 HydrophobicContact CD2-CD1 4.01Å; L222-L251 HydrophobicContact CD1-CB 3.91Å; L222-L251 WeakPolarHBondContact CD1-O 3.44Å; L222-L251 HydrophobicContact CD2-CB 4.36Å; L222-L251 HydrophobicContact CD2-CD1 4.45Å; L222-Q253 HydrophobicContact CB-CB 4.2Å; L222-Q253 HydrophobicContact CB-CG 4.33Å; L222-Q253 HydrophobicContact CD1-CB 4.22Å; L222-Q253 PolarHBondContact O-NE2 2.76Å
223	D	91.2	Very high	94.2	Very high	36 Å²	36	24.3 Å²	24.3	19%	0.193	13%	0.133	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.9	11.6	-179	74.1	-8	0	0	0	113.8	K137 H221	K137-D223 IonicContact NZ-OD1 3.61Å; K137-D223 PolarHBondContact NZ-OD1 2.66Å; K137-D223 IonicContact NZ-OD2 3.03Å; K137-D223 PolarHBondContact NZ-OD2 3.23Å; H221-D223 PolarHBondContact O-N 2.66Å
224	Y	94.5	Very high	94.2	Very high	28 Å²	28	22.8 Å²	22.8	11%	0.11	13%	0.125	C	C	.	.			trans	-65.8	138.7	170.1	-160.3	-84.5	0	0	0	110	N73 K137 N188 F189 Q190 I197 H221 L222	N73-Y224 HydrophobicContact CB-CD2 4.25Å; N73-Y224 HydrophobicContact CB-CE2 3.82Å; N73-Y224 VanDerWaalsContact ND2-CE1 3.26Å; N73-Y224 WeakPolarHBondContact ND2-CE1 3.22Å; K137-Y224 HydrophobicContact CB-CD2 4.12Å; K137-Y224 HydrophobicContact CB-CE2 4.39Å; N188-Y224 VanDerWaalsContact C-CZ 3.48Å; N188-Y224 HydrophobicContact CB-CD2 3.83Å; N188-Y224 HydrophobicContact CB-CE2 3.65Å; N188-Y224 PolarHBondContact O-OH 3.29Å; F189-Y224 WeakPolarHBondContact CA-OH 3.35Å; Q190-Y224 HydrophobicContact CG-CE1 4.13Å; I197-Y224 HydrophobicContact CB-CD1 4.27Å; I197-Y224 HydrophobicContact CD1-CD1 4.2Å; I197-Y224 WeakPolarHBondContact CD1-O 3.48Å; I197-Y224 HydrophobicContact CG2-CD1 3.8Å; I197-Y224 HydrophobicContact CG2-CE1 3.82Å; H221-Y224 WeakPolarHBondContact O-CB 3.4Å; H221-Y224 PolarHBondContact O-N 3.37Å; L222-Y224 VanDerWaalsContact C-N 3.34Å
225	R	94.9	Very high	94.2	Very high	37 Å²	37	23 Å²	23	14%	0.14	12%	0.124	C	C	.	.	B	Isolated β-bridge	trans	-112.5	146.5	-172.9	-70.9	175.7	164.3	120.4	-12.4	113	L72 N73 Q190 T229 M230 T231 R258	L72-R225 HydrophobicContact CD2-CB 3.94Å; L72-R225 HydrophobicContact CG-CB 4.26Å; N73-R225 PolarHBondContact ND2-O 3.38Å; N73-R225 PolarHBondContact OD1-N 3.1Å; Q190-R225 PolarHBondContact NE2-O 3.18Å; R225-T229 WeakPolarHBondContact CD-O 3.4Å; R225-T229 VanDerWaalsContact CG-O 3.27Å; R225-T229 WeakPolarHBondContact CG-O 3.15Å; R225-T229 PolarHBondContact NE-O 3.5Å; R225-M230 CarbonylContact C-O 3.58Å; R225-M230 VanDerWaalsContact CA-O 3.28Å; R225-M230 WeakPolarHBondContact CA-O 3.5Å; R225-T231 HydrophobicContact CG-CG2 3.83Å; R225-R258 PolarHBondContact NH2-O 3.12Å
226	D	95	Very high	94.2	Very high	2 Å²	2	23 Å²	23	1%	0.011	12%	0.124	C	C	.	.			trans	-82.1	-175.5	171.8	67	28.3	0	0	0	113	Q190 G195 I197 D228 T229 M230 R235	Q190-D226 PolarHBondContact NE2-O 2.83Å; G195-D226 WeakPolarHBondContact O-CB 3.42Å; I197-D226 HydrophobicContact CG1-CB 4.43Å; I197-D226 HydrophobicContact CG2-CB 3.9Å; D226-D228 PolarHBondContact O-N 3.36Å; D226-D228 VanDerWaalsContact OD1-CA 3.31Å; D226-D228 WeakPolarHBondContact OD1-CA 3.34Å; D226-D228 WeakPolarHBondContact OD1-CB 3.41Å; D226-D228 PolarHBondContact OD1-N 3.23Å; D226-T229 WeakPolarHBondContact O-CA 3.4Å; D226-T229 PolarHBondContact O-N 3.49Å; D226-T229 PolarHBondContact OD1-N 3.11Å; D226-M230 PolarHBondContact N-O 2.77Å; D226-M230 PolarHBondContact OD1-N 3.21Å; D226-R235 IonicContact OD1-NH2 3.45Å; D226-R235 IonicContact OD2-CZ 2.85Å; D226-R235 IonicContact OD2-NE 3.09Å; D226-R235 PolarHBondContact OD2-NE 2.93Å; D226-R235 IonicContact OD2-NH2 3.59Å; D226-R235 PolarHBondContact OD2-NH2 3.25Å
227	S	92.4	Very high	94.2	Very high	59 Å²	59	22.7 Å²	22.7	41%	0.413	12%	0.122	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-20	178.5	61.9	0	0	0	0	114.6	G195	G195-S227 WeakPolarHBondContact CA-OG 3.26Å; G195-S227 PolarHBondContact O-N 3.05Å
228	D	91.5	Very high	94.3	Very high	56 Å²	56	21.2 Å²	21.2	30%	0.299	11%	0.113	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.7	1.5	169.8	-75.2	-54.4	0	0	0	112.3	D226 M230 R235 K260	D226-D228 PolarHBondContact O-N 3.36Å; D226-D228 VanDerWaalsContact OD1-CA 3.31Å; D226-D228 WeakPolarHBondContact OD1-CA 3.34Å; D226-D228 WeakPolarHBondContact OD1-CB 3.41Å; D226-D228 PolarHBondContact OD1-N 3.23Å; D228-M230 HydrophobicContact CB-CG 4.14Å; D228-M230 HydrophobicContact CB-SD 4.27Å; D228-M230 PolarHBondContact O-N 3.47Å; D228-R235 IonicContact OD2-CZ 3.26Å; D228-R235 IonicContact OD2-NH2 2.77Å; D228-R235 PolarHBondContact OD2-NH2 3.3Å; D228-K260 VanDerWaalsContact O-CD 3.3Å; D228-K260 WeakPolarHBondContact O-CD 3.43Å; D228-K260 WeakPolarHBondContact O-CE 3.35Å; D228-K260 IonicContact OD1-NZ 3.17Å; D228-K260 PolarHBondContact OD1-NZ 2.75Å
229	T	92.6	Very high	94.4	Very high	9 Å²	9	24.2 Å²	24.2	6%	0.055	13%	0.128	C	C	.	.	S	Bend	trans	68	12	-172.5	77.4	0	0	0	0	114.6	L72 R225 D226 K260	L72-T229 HydrophobicContact CD1-CG2 4.24Å; L72-T229 HydrophobicContact CD2-CG2 3.55Å; R225-T229 WeakPolarHBondContact CD-O 3.4Å; R225-T229 VanDerWaalsContact CG-O 3.27Å; R225-T229 WeakPolarHBondContact CG-O 3.15Å; R225-T229 PolarHBondContact NE-O 3.5Å; D226-T229 WeakPolarHBondContact O-CA 3.4Å; D226-T229 PolarHBondContact O-N 3.49Å; D226-T229 PolarHBondContact OD1-N 3.11Å; T229-K260 HydrophobicContact CG2-CB 3.97Å; T229-K260 HydrophobicContact CG2-CD 4.35Å; T229-K260 HydrophobicContact CG2-CG 4.47Å; T229-K260 WeakPolarHBondContact OG1-CB 3.38Å; T229-K260 PolarHBondContact OG1-N 3.17Å
230	M	95.2	Very high	94.6	Very high	13 Å²	13	23.9 Å²	23.9	6%	0.064	13%	0.125	C	C	.	.			trans	-82.6	144.8	179.3	-70.5	-179.3	176.3	0	0	110.9	R225 D226 D228 H234 I238 D259 Y268	R225-M230 CarbonylContact C-O 3.58Å; R225-M230 VanDerWaalsContact CA-O 3.28Å; R225-M230 WeakPolarHBondContact CA-O 3.5Å; D226-M230 PolarHBondContact N-O 2.77Å; D226-M230 PolarHBondContact OD1-N 3.21Å; D228-M230 HydrophobicContact CB-CG 4.14Å; D228-M230 HydrophobicContact CB-SD 4.27Å; D228-M230 PolarHBondContact O-N 3.47Å; M230-H234 HydrophobicContact CB-CB 3.85Å; M230-H234 HydrophobicContact CG-CB 4.12Å; M230-H234 HydrophobicContact SD-CB 4.49Å; M230-I238 HydrophobicContact CE-CD1 4.08Å; M230-I238 HydrophobicContact SD-CD1 3.69Å; M230-D259 HydrophobicContact CG-CB 4.26Å; M230-Y268 HydrophobicContact CE-CE1 3.95Å; M230-Y268 HydrophobicContact CE-CE2 3.86Å; M230-Y268 VanDerWaalsContact CE-CZ 3.44Å; M230-Y268 VanDerWaalsContact CE-OH 3.3Å; M230-Y268 WeakPolarHBondContact CE-OH 3.38Å
231	T	95.7	Very high	94.6	Very high	1 Å²	1	24.5 Å²	24.5	1%	0.006	13%	0.127	C	C	.	.	B	Isolated β-bridge	trans	-90.1	170	170.9	64	0	0	0	0	111.6	R225 L233 H234 R235 Q253 V257	R225-T231 HydrophobicContact CG-CG2 3.83Å; T231-L233 PolarHBondContact O-N 3.32Å; T231-H234 PolarHBondContact N-ND1 2.92Å; T231-H234 WeakPolarHBondContact O-CB 3.4Å; T231-H234 PolarHBondContact O-N 2.93Å; T231-H234 PolarHBondContact OG1-ND1 3.25Å; T231-R235 PolarHBondContact O-N 2.8Å; T231-Q253 PolarHBondContact OG1-NE2 2.73Å; T231-V257 HydrophobicContact CG2-CG1 3.77Å
232	A	97	Very high	94.8	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-55.8	-34.8	175.5	0	0	0	0	0	113.6	L199 R235 A236 F248	L199-A232 HydrophobicContact CB-CB 3.66Å; A232-R235 PolarHBondContact O-N 2.76Å; A232-A236 WeakPolarHBondContact O-CB 3.41Å; A232-A236 PolarHBondContact O-N 3.13Å; A232-F248 HydrophobicContact CB-CD2 4.49Å; A232-F248 HydrophobicContact CB-CE1 3.88Å; A232-F248 HydrophobicContact CB-CE2 3.76Å; A232-F248 HydrophobicContact CB-CZ 3.43Å; A232-F248 VanDerWaalsContact CB-CZ 3.43Å
233	L	97.2	Very high	95	Very high	0 Å²	0	27 Å²	27	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-67.2	-31.4	174.4	-176	60.9	0	0	0	113.6	T231 A237 I245 F248 L249 Q253 P255 P265 L282	T231-L233 PolarHBondContact O-N 3.32Å; L233-A237 WeakPolarHBondContact O-CB 3.3Å; L233-A237 PolarHBondContact O-N 3.42Å; L233-I245 HydrophobicContact CD1-CB 4.28Å; L233-I245 HydrophobicContact CD1-CG1 4.21Å; L233-I245 HydrophobicContact CD1-CG2 4.12Å; L233-F248 HydrophobicContact CD1-CB 4.26Å; L233-F248 HydrophobicContact CD1-CD2 4.5Å; L233-L249 HydrophobicContact CD1-CG 4.42Å; L233-L249 HydrophobicContact CD2-CD2 3.94Å; L233-Q253 HydrophobicContact CB-CG 4.31Å; L233-Q253 HydrophobicContact CD2-CG 4.1Å; L233-P255 HydrophobicContact CD2-CB 4.46Å; L233-P265 HydrophobicContact CB-CG 4.44Å; L233-P265 HydrophobicContact CD2-CB 4.49Å; L233-P265 HydrophobicContact CD2-CG 4.1Å; L233-P265 HydrophobicContact CG-CB 4.05Å; L233-P265 HydrophobicContact CG-CG 3.92Å; L233-L282 HydrophobicContact CD1-CD2 4.34Å; L233-L282 HydrophobicContact CD2-CD2 4.41Å
234	H	96.7	Very high	95.3	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-66.3	-46	171.6	-71.3	78.2	0	0	0	110.6	M230 T231 A236 A237 I238 V257 L263 P265 Y268	M230-H234 HydrophobicContact CB-CB 3.85Å; M230-H234 HydrophobicContact CG-CB 4.12Å; M230-H234 HydrophobicContact SD-CB 4.49Å; T231-H234 PolarHBondContact N-ND1 2.92Å; T231-H234 WeakPolarHBondContact O-CB 3.4Å; T231-H234 PolarHBondContact O-N 2.93Å; T231-H234 PolarHBondContact OG1-ND1 3.25Å; H234-A236 VanDerWaalsContact C-N 3.34Å; H234-A236 PolarHBondContact O-N 2.89Å; H234-A237 WeakPolarHBondContact O-CB 3.25Å; H234-A237 PolarHBondContact O-N 2.85Å; H234-I238 VanDerWaalsContact O-CG1 3.31Å; H234-I238 WeakPolarHBondContact O-CG1 3.27Å; H234-I238 PolarHBondContact O-N 2.7Å; H234-V257 PolarHBondContact CE1-O 3.21Å; H234-V257 VanDerWaalsContact CE1-O 3.28Å; H234-V257 PolarHBondContact NE2-O 2.86Å; H234-L263 PolarHBondContact NE2-O 3.2Å; H234-P265 WeakPolarHBondContact NE2-CD 3.33Å; H234-Y268 AromaticContact CD2-CD2 3.98Å
235	R	96.1	Very high	95.4	Very high	57 Å²	57	24 Å²	24	22%	0.215	12%	0.122	C	C	.	.	H	α-helix	trans	-62.9	-40.4	176.1	-61.8	-64.1	-179.6	-179.2	-2.6	111.5	A203 D226 D228 T231 A232 A237 I238 N239	A203-R235 HydrophobicContact CB-CB 4.36Å; D226-R235 IonicContact OD1-NH2 3.45Å; D226-R235 IonicContact OD2-CZ 2.85Å; D226-R235 IonicContact OD2-NE 3.09Å; D226-R235 PolarHBondContact OD2-NE 2.93Å; D226-R235 IonicContact OD2-NH2 3.59Å; D226-R235 PolarHBondContact OD2-NH2 3.25Å; D228-R235 IonicContact OD2-CZ 3.26Å; D228-R235 IonicContact OD2-NH2 2.77Å; D228-R235 PolarHBondContact OD2-NH2 3.3Å; T231-R235 PolarHBondContact O-N 2.8Å; A232-R235 PolarHBondContact O-N 2.76Å; R235-A237 VanDerWaalsContact C-N 3.33Å; R235-A237 PolarHBondContact O-N 2.85Å; R235-I238 PolarHBondContact O-N 3.26Å; R235-N239 VanDerWaalsContact O-CB 3.28Å; R235-N239 WeakPolarHBondContact O-CB 3.23Å; R235-N239 PolarHBondContact O-N 3.4Å; R235-N239 PolarHBondContact O-ND2 2.74Å
236	A	96.8	Very high	95.4	Very high	0 Å²	0	25 Å²	25	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-60.1	-40.1	173.6	0	0	0	0	0	113.1	A203 A232 H234 G240 N241 A244 I245 F248	A203-A236 HydrophobicContact CB-CB 4.04Å; A232-A236 WeakPolarHBondContact O-CB 3.41Å; A232-A236 PolarHBondContact O-N 3.13Å; H234-A236 VanDerWaalsContact C-N 3.34Å; H234-A236 PolarHBondContact O-N 2.89Å; A236-G240 PolarHBondContact O-N 3.07Å; A236-N241 PolarHBondContact O-N 3.48Å; A236-A244 HydrophobicContact CB-CB 3.69Å; A236-I245 HydrophobicContact CB-CG1 3.74Å; A236-F248 HydrophobicContact CB-CD2 4.1Å; A236-F248 HydrophobicContact CB-CE2 4.07Å
237	A	96.3	Very high	95.5	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-66.9	-50.3	175.3	0	0	0	0	0	112.3	L233 H234 R235 N239 G240 P265 A269 I274	L233-A237 WeakPolarHBondContact O-CB 3.3Å; L233-A237 PolarHBondContact O-N 3.42Å; H234-A237 WeakPolarHBondContact O-CB 3.25Å; H234-A237 PolarHBondContact O-N 2.85Å; R235-A237 VanDerWaalsContact C-N 3.33Å; R235-A237 PolarHBondContact O-N 2.85Å; A237-N239 VanDerWaalsContact C-N 3.27Å; A237-N239 PolarHBondContact O-N 2.76Å; A237-G240 PolarHBondContact O-N 3.46Å; A237-P265 HydrophobicContact CB-CB 4.02Å; A237-P265 VanDerWaalsContact CB-O 3.29Å; A237-P265 WeakPolarHBondContact CB-O 3.35Å; A237-A269 HydrophobicContact CB-CB 4.27Å; A237-I274 WeakPolarHBondContact O-CD1 3.05Å
238	I	94.7	Very high	95.7	Very high	41 Å²	41	22.3 Å²	22.3	21%	0.21	11%	0.11	C	C	.	.	H	α-helix	trans	-56.4	-42	176.5	-68.1	164.1	0	0	0	111	M230 H234 R235 G240 Y268 E272	M230-I238 HydrophobicContact CE-CD1 4.08Å; M230-I238 HydrophobicContact SD-CD1 3.69Å; H234-I238 VanDerWaalsContact O-CG1 3.31Å; H234-I238 WeakPolarHBondContact O-CG1 3.27Å; H234-I238 PolarHBondContact O-N 2.7Å; R235-I238 PolarHBondContact O-N 3.26Å; I238-G240 VanDerWaalsContact C-N 3.26Å; I238-G240 PolarHBondContact O-N 3.23Å; I238-Y268 HydrophobicContact CD1-CD1 4.03Å; I238-Y268 HydrophobicContact CD1-CE1 4.49Å; I238-Y268 HydrophobicContact CD1-CG 4.13Å; I238-Y268 HydrophobicContact CG1-CD1 3.89Å; I238-Y268 HydrophobicContact CG1-CG 3.86Å; I238-E272 HydrophobicContact CG2-CG 4.31Å
239	N	93.4	Very high	95.8	Very high	75 Å²	75	20 Å²	20	40%	0.401	10%	0.097	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.2	-2.8	179.5	-64.5	-14.8	0	0	0	114.2	A203 E204 R235 A237 N241	A203-N239 PolarHBondContact O-ND2 2.99Å; E204-N239 VanDerWaalsContact CG-ND2 3.34Å; E204-N239 WeakPolarHBondContact CG-ND2 3.31Å; R235-N239 VanDerWaalsContact O-CB 3.28Å; R235-N239 WeakPolarHBondContact O-CB 3.23Å; R235-N239 PolarHBondContact O-N 3.4Å; R235-N239 PolarHBondContact O-ND2 2.74Å; A237-N239 VanDerWaalsContact C-N 3.27Å; A237-N239 PolarHBondContact O-N 2.76Å; N239-N241 HydrophobicContact CB-CB 4.32Å; N239-N241 PolarHBondContact O-N 3.05Å
240	G	94.6	Very high	95.8	Very high	10 Å²	10	24.2 Å²	24.2	10%	0.103	12%	0.116	C	C	.	.	T	Hydrogen-bonded Turn	trans	61.3	22.5	-174.4	0	0	0	0	0	114.6	A236 A237 I238 F242 I274 R275 C278	A236-G240 PolarHBondContact O-N 3.07Å; A237-G240 PolarHBondContact O-N 3.46Å; I238-G240 VanDerWaalsContact C-N 3.26Å; I238-G240 PolarHBondContact O-N 3.23Å; G240-F242 PolarHBondContact O-N 2.76Å; G240-I274 VanDerWaalsContact CA-CG2 3.44Å; G240-R275 PolarHBondContact O-NH2 3.17Å; G240-C278 PolarHBondContact O-SG 3.19Å; G240-C278 VanDerWaalsContact O-SG 3.42Å
241	N	95.7	Very high	95.6	Very high	19 Å²	19	25.8 Å²	25.8	10%	0.102	12%	0.124	C	C	.	.			trans	-86.6	78.3	-171.1	-168.9	-9.2	0	0	0	111.3	A203 L205 A236 N239 K243 A244 I245	A203-N241 PolarHBondContact O-ND2 2.95Å; L205-N241 PolarHBondContact O-ND2 3.11Å; A236-N241 PolarHBondContact O-N 3.48Å; N239-N241 HydrophobicContact CB-CB 4.32Å; N239-N241 PolarHBondContact O-N 3.05Å; N241-K243 PolarHBondContact O-N 3.02Å; N241-K243 VanDerWaalsContact O-N 3.09Å; N241-K243 PolarHBondContact OD1-N 2.92Å; N241-A244 HydrophobicContact CB-CB 4.03Å; N241-A244 PolarHBondContact O-N 2.88Å; N241-A244 PolarHBondContact OD1-N 2.99Å; N241-I245 WeakPolarHBondContact O-CG1 3.2Å; N241-I245 PolarHBondContact O-N 2.83Å
242	F	96.1	Very high	95.3	Very high	43 Å²	43	27.7 Å²	27.7	19%	0.189	15%	0.145	C	C	.	.	H	α-helix	trans	-44.3	-41.9	176.1	-178.3	-89.4	0	0	0	113.7	G240 I245 E246 R275 E277 R281	G240-F242 PolarHBondContact O-N 2.76Å; F242-I245 PolarHBondContact O-N 2.88Å; F242-E246 HydrophobicContact CE1-CB 4.35Å; F242-E246 WeakPolarHBondContact CE1-OE2 3.49Å; F242-E246 VanDerWaalsContact O-CB 3.25Å; F242-E246 WeakPolarHBondContact O-CB 3.46Å; F242-E246 PolarHBondContact O-N 3.44Å; F242-R275 VanDerWaalsContact CB-NH2 3.31Å; F242-E277 HydrophobicContact CD2-CB 3.64Å; F242-E277 HydrophobicContact CE2-CB 3.72Å; F242-E277 WeakPolarHBondContact CE2-O 3.41Å; F242-R281 HydrophobicContact CD2-CB 4.4Å; F242-R281 HydrophobicContact CE2-CB 3.87Å; F242-R281 HydrophobicContact CE2-CG 4.18Å; F242-R281 HydrophobicContact CZ-CG 4.47Å
243	K	96.7	Very high	95	Very high	82 Å²	82	28 Å²	28	36%	0.357	15%	0.146	S	C	.	.	H	α-helix	trans	-65	-43.6	-179.4	-67.5	-176.5	179	179.9	0	111.7	A206 D207 P208 N241 V247	A206-K243 WeakPolarHBondContact O-CD 3.26Å; A206-K243 PolarHBondContact O-NZ 3.01Å; D207-K243 VanDerWaalsContact CG-NZ 3.33Å; D207-K243 WeakPolarHBondContact OD1-CD 3.4Å; D207-K243 WeakPolarHBondContact OD1-CE 3.44Å; D207-K243 IonicContact OD1-NZ 2.72Å; D207-K243 PolarHBondContact OD1-NZ 2.98Å; P208-K243 HydrophobicContact CG-CB 3.86Å; N241-K243 PolarHBondContact O-N 3.02Å; N241-K243 VanDerWaalsContact O-N 3.09Å; N241-K243 PolarHBondContact OD1-N 2.92Å; K243-V247 WeakPolarHBondContact O-CB 3.49Å; K243-V247 VanDerWaalsContact O-CG2 3.25Å; K243-V247 WeakPolarHBondContact O-CG2 3.37Å; K243-V247 PolarHBondContact O-N 3.47Å
244	A	97.5	Very high	94.5	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-64.4	-45	175.1	0	0	0	0	0	110.9	A203 P208 I212 A236 N241 E246 V247 F248	A203-A244 HydrophobicContact CB-CB 4.26Å; P208-A244 HydrophobicContact CB-CB 4.36Å; P208-A244 HydrophobicContact CG-CB 3.83Å; I212-A244 HydrophobicContact CD1-CB 4.29Å; A236-A244 HydrophobicContact CB-CB 3.69Å; N241-A244 HydrophobicContact CB-CB 4.03Å; N241-A244 PolarHBondContact O-N 2.88Å; N241-A244 PolarHBondContact OD1-N 2.99Å; A244-E246 PolarHBondContact O-N 2.72Å; A244-V247 PolarHBondContact O-N 3.3Å; A244-F248 HydrophobicContact CB-CD2 4.26Å; A244-F248 HydrophobicContact CB-CE2 3.96Å; A244-F248 WeakPolarHBondContact O-CB 3.49Å; A244-F248 WeakPolarHBondContact O-CD2 3.34Å; A244-F248 VanDerWaalsContact O-CG 3.32Å; A244-F248 WeakPolarHBondContact O-CG 3.25Å; A244-F248 PolarHBondContact O-N 3.2Å
245	I	97.4	Very high	94.2	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-56.1	-50.6	176.3	-64.6	171.9	0	0	0	110.6	L233 A236 N241 F242 F248 L249 C278 R281 L282	L233-I245 HydrophobicContact CD1-CB 4.28Å; L233-I245 HydrophobicContact CD1-CG1 4.21Å; L233-I245 HydrophobicContact CD1-CG2 4.12Å; A236-I245 HydrophobicContact CB-CG1 3.74Å; N241-I245 WeakPolarHBondContact O-CG1 3.2Å; N241-I245 PolarHBondContact O-N 2.83Å; F242-I245 PolarHBondContact O-N 2.88Å; I245-F248 PolarHBondContact O-N 2.99Å; I245-L249 HydrophobicContact CG2-CD1 3.6Å; I245-L249 HydrophobicContact CG2-CG 4.47Å; I245-L249 WeakPolarHBondContact O-CB 3.24Å; I245-L249 WeakPolarHBondContact O-CD1 3.37Å; I245-L249 WeakPolarHBondContact O-CG 3.3Å; I245-L249 PolarHBondContact O-N 2.92Å; I245-C278 HydrophobicContact CD1-CB 3.61Å; I245-R281 HydrophobicContact CG2-CB 4.32Å; I245-R281 HydrophobicContact CG2-CG 4.24Å; I245-L282 HydrophobicContact CG2-CD2 4.22Å; I245-L282 HydrophobicContact CG2-CG 4.11Å
246	E	95.8	Very high	93.9	Very high	59 Å²	59	27.8 Å²	27.8	28%	0.276	15%	0.149	S	C	.	.	H	α-helix	trans	-58.4	-50.4	178.7	175.5	152.7	-97.2	0	0	112.3	F242 A244 L249 E250 R281	F242-E246 HydrophobicContact CE1-CB 4.35Å; F242-E246 WeakPolarHBondContact CE1-OE2 3.49Å; F242-E246 VanDerWaalsContact O-CB 3.25Å; F242-E246 WeakPolarHBondContact O-CB 3.46Å; F242-E246 PolarHBondContact O-N 3.44Å; A244-E246 PolarHBondContact O-N 2.72Å; E246-L249 PolarHBondContact O-N 3.24Å; E246-E250 WeakPolarHBondContact O-CB 3.41Å; E246-E250 WeakPolarHBondContact O-CG 3.22Å; E246-E250 PolarHBondContact O-N 3.32Å; E246-R281 IonicContact OE1-CZ 2.7Å; E246-R281 IonicContact OE1-NE 2.92Å; E246-R281 PolarHBondContact OE1-NE 2.92Å; E246-R281 IonicContact OE1-NH2 3.76Å
247	V	96.6	Very high	93.5	Very high	4 Å²	4	28.7 Å²	28.7	2%	0.024	16%	0.155	C	C	.	.	H	α-helix	trans	-66.9	-40.5	-178.9	174.3	0	0	0	0	112	R209 I212 K243 A244 L249 E250 L251	R209-V247 HydrophobicContact CB-CG2 3.89Å; R209-V247 HydrophobicContact CG-CG1 4.39Å; R209-V247 HydrophobicContact CG-CG2 3.61Å; I212-V247 HydrophobicContact CB-CG1 4.12Å; I212-V247 HydrophobicContact CD1-CB 4.38Å; I212-V247 HydrophobicContact CD1-CG1 4.2Å; I212-V247 HydrophobicContact CG2-CG1 3.84Å; K243-V247 WeakPolarHBondContact O-CB 3.49Å; K243-V247 VanDerWaalsContact O-CG2 3.25Å; K243-V247 WeakPolarHBondContact O-CG2 3.37Å; K243-V247 PolarHBondContact O-N 3.47Å; A244-V247 PolarHBondContact O-N 3.3Å; V247-L249 VanDerWaalsContact C-N 3.32Å; V247-L249 PolarHBondContact O-N 3.09Å; V247-E250 PolarHBondContact O-N 3.28Å; V247-L251 HydrophobicContact CG1-CD1 3.91Å; V247-L251 WeakPolarHBondContact O-CB 3.4Å; V247-L251 VanDerWaalsContact O-CG 3.25Å; V247-L251 WeakPolarHBondContact O-CG 3.34Å; V247-L251 PolarHBondContact O-N 3.43Å
248	F	96	Very high	93.1	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-63.8	-38	175.1	-71.5	-46.6	0	0	0	112.2	L199 A203 I212 L222 A232 L233 A236 A244 I245 L251 G252 Q253	L199-F248 HydrophobicContact CD2-CE1 4.48Å; A203-F248 HydrophobicContact CB-CE2 3.9Å; A203-F248 HydrophobicContact CB-CZ 4.31Å; I212-F248 HydrophobicContact CB-CE1 4.4Å; I212-F248 HydrophobicContact CD1-CD1 4.23Å; I212-F248 HydrophobicContact CD1-CD2 4.47Å; I212-F248 HydrophobicContact CD1-CE1 3.65Å; I212-F248 HydrophobicContact CD1-CE2 3.92Å; I212-F248 HydrophobicContact CD1-CZ 3.46Å; I212-F248 VanDerWaalsContact CD1-CZ 3.46Å; I212-F248 HydrophobicContact CG1-CE1 3.81Å; I212-F248 HydrophobicContact CG1-CZ 3.82Å; I212-F248 HydrophobicContact CG2-CD1 3.99Å; I212-F248 HydrophobicContact CG2-CE1 3.64Å; I212-F248 HydrophobicContact CG2-CZ 4.49Å; L222-F248 HydrophobicContact CD2-CD1 4.01Å; A232-F248 HydrophobicContact CB-CD2 4.49Å; A232-F248 HydrophobicContact CB-CE1 3.88Å; A232-F248 HydrophobicContact CB-CE2 3.76Å; A232-F248 HydrophobicContact CB-CZ 3.43Å; A232-F248 VanDerWaalsContact CB-CZ 3.43Å; L233-F248 HydrophobicContact CD1-CB 4.26Å; L233-F248 HydrophobicContact CD1-CD2 4.5Å; A236-F248 HydrophobicContact CB-CD2 4.1Å; A236-F248 HydrophobicContact CB-CE2 4.07Å; A244-F248 HydrophobicContact CB-CD2 4.26Å; A244-F248 HydrophobicContact CB-CE2 3.96Å; A244-F248 WeakPolarHBondContact O-CB 3.49Å; A244-F248 WeakPolarHBondContact O-CD2 3.34Å; A244-F248 VanDerWaalsContact O-CG 3.32Å; A244-F248 WeakPolarHBondContact O-CG 3.25Å; A244-F248 PolarHBondContact O-N 3.2Å; I245-F248 PolarHBondContact O-N 2.99Å; F248-L251 PolarHBondContact O-N 3.34Å; F248-G252 PolarHBondContact O-N 2.73Å; F248-Q253 HydrophobicContact CB-CB 4.29Å; F248-Q253 WeakPolarHBondContact O-CB 3.3Å; F248-Q253 PolarHBondContact O-N 3.3Å
249	L	93.8	Very high	92.9	Very high	6 Å²	6	30.4 Å²	30.4	3%	0.031	16%	0.159	C	C	.	.	H	α-helix	trans	-76.1	-34.3	178.4	-66.2	168.5	0	0	0	112.9	L233 I245 E246 V247 L251 G252 P255 R281 L282 D285 R402	L233-L249 HydrophobicContact CD1-CG 4.42Å; L233-L249 HydrophobicContact CD2-CD2 3.94Å; I245-L249 HydrophobicContact CG2-CD1 3.6Å; I245-L249 HydrophobicContact CG2-CG 4.47Å; I245-L249 WeakPolarHBondContact O-CB 3.24Å; I245-L249 WeakPolarHBondContact O-CD1 3.37Å; I245-L249 WeakPolarHBondContact O-CG 3.3Å; I245-L249 PolarHBondContact O-N 2.92Å; E246-L249 PolarHBondContact O-N 3.24Å; V247-L249 VanDerWaalsContact C-N 3.32Å; V247-L249 PolarHBondContact O-N 3.09Å; L249-L251 VanDerWaalsContact C-N 3.33Å; L249-G252 PolarHBondContact O-N 2.91Å; L249-G252 VanDerWaalsContact O-N 3.12Å; L249-P255 HydrophobicContact CD2-CB 3.92Å; L249-P255 HydrophobicContact CD2-CG 4.23Å; L249-R281 HydrophobicContact CD1-CG 4.16Å; L249-L282 HydrophobicContact CD1-CD2 4.2Å; L249-D285 VanDerWaalsContact CB-OD2 3.23Å; L249-D285 WeakPolarHBondContact CB-OD2 3.4Å; L249-D285 HydrophobicContact CD1-CB 4.2Å; L249-D285 WeakPolarHBondContact CD1-OD2 3.27Å; L249-D285 HydrophobicContact CD2-CB 4.26Å; L249-R402 PolarHBondContact O-NH2 2.76Å
250	E	92.9	Very high	92.7	Very high	99 Å²	99	32.1 Å²	32.1	46%	0.463	16%	0.163	S	C	.	.	H	α-helix	trans	-58.2	-44.2	167.8	-80.5	179	-177.1	0	0	111.3	R209 E246 V247 G252	R209-E250 IonicContact CZ-OE2 2.83Å; R209-E250 IonicContact NE-OE2 3.15Å; R209-E250 IonicContact NH2-OE2 3.85Å; R209-E250 PolarHBondContact NH2-OE2 3.06Å; E246-E250 WeakPolarHBondContact O-CB 3.41Å; E246-E250 WeakPolarHBondContact O-CG 3.22Å; E246-E250 PolarHBondContact O-N 3.32Å; V247-E250 PolarHBondContact O-N 3.28Å; E250-G252 PolarHBondContact O-N 3.41Å; E250-G252 VanDerWaalsContact O-N 3.14Å
251	L	91.3	Very high	92.5	Very high	45 Å²	45	35.4 Å²	35.4	24%	0.236	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.5	5	176.1	-66.9	169.7	0	0	0	113.6	I212 L213 V216 L222 V247 F248 L249	I212-L251 HydrophobicContact CG2-CD1 3.66Å; L213-L251 HydrophobicContact CD2-CD1 4.22Å; L213-L251 HydrophobicContact CD2-CD2 3.92Å; V216-L251 HydrophobicContact CG2-CD1 4.26Å; L222-L251 HydrophobicContact CD1-CB 3.91Å; L222-L251 WeakPolarHBondContact CD1-O 3.44Å; L222-L251 HydrophobicContact CD2-CB 4.36Å; L222-L251 HydrophobicContact CD2-CD1 4.45Å; V247-L251 HydrophobicContact CG1-CD1 3.91Å; V247-L251 WeakPolarHBondContact O-CB 3.4Å; V247-L251 VanDerWaalsContact O-CG 3.25Å; V247-L251 WeakPolarHBondContact O-CG 3.34Å; V247-L251 PolarHBondContact O-N 3.43Å; F248-L251 PolarHBondContact O-N 3.34Å; L249-L251 VanDerWaalsContact C-N 3.33Å
252	G	88	Confident	92.1	Very high	42 Å²	42	37.1 Å²	37.1	43%	0.433	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	90.2	2.3	170.8	0	0	0	0	0	115.7	F248 L249 E250 N254 R402	F248-G252 PolarHBondContact O-N 2.73Å; L249-G252 PolarHBondContact O-N 2.91Å; L249-G252 VanDerWaalsContact O-N 3.12Å; E250-G252 PolarHBondContact O-N 3.41Å; E250-G252 VanDerWaalsContact O-N 3.14Å; G252-N254 PolarHBondContact O-N 3.13Å; G252-R402 VanDerWaalsContact C-NH2 3.28Å; G252-R402 PolarHBondContact O-NH2 2.61Å
253	Q	90.7	Very high	92	Very high	6 Å²	6	35.7 Å²	35.7	3%	0.028	18%	0.182	C	C	.	.			trans	-53.7	134.4	179.8	-176.6	158	15.2	0	0	111.2	L222 T231 L233 F248 P255 R402	L222-Q253 HydrophobicContact CB-CB 4.2Å; L222-Q253 HydrophobicContact CB-CG 4.33Å; L222-Q253 HydrophobicContact CD1-CB 4.22Å; L222-Q253 PolarHBondContact O-NE2 2.76Å; T231-Q253 PolarHBondContact OG1-NE2 2.73Å; L233-Q253 HydrophobicContact CB-CG 4.31Å; L233-Q253 HydrophobicContact CD2-CG 4.1Å; F248-Q253 HydrophobicContact CB-CB 4.29Å; F248-Q253 WeakPolarHBondContact O-CB 3.3Å; F248-Q253 PolarHBondContact O-N 3.3Å; Q253-P255 WeakPolarHBondContact O-CD 3.46Å; Q253-R402 PolarHBondContact O-NH1 3.29Å; Q253-R402 VanDerWaalsContact O-NH1 3.17Å; Q253-R402 PolarHBondContact O-NH2 2.92Å
254	N	87.1	Confident	91.9	Very high	29 Å²	29	31.9 Å²	31.9	16%	0.155	17%	0.166	C	C	.	.			trans	-70.1	121.8	179.3	178.2	9.7	0	0	0	110.5	G252 N256 V257	G252-N254 PolarHBondContact O-N 3.13Å; N254-N256 PolarHBondContact O-N 3.37Å; N254-N256 WeakPolarHBondContact OD1-CB 3.38Å; N254-N256 PolarHBondContact OD1-N 2.76Å; N254-V257 HydrophobicContact CB-CG2 3.97Å; N254-V257 WeakPolarHBondContact O-CG2 3.11Å
255	P	90.9	Very high	91.8	Very high	1 Å²	1	31.9 Å²	31.9	1%	0.006	17%	0.166	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.7	-10.3	176.3	27.1	-32.6	0	0	0	113.6	L233 L249 Q253 P265 L282 D285 A287	L233-P255 HydrophobicContact CD2-CB 4.46Å; L249-P255 HydrophobicContact CD2-CB 3.92Å; L249-P255 HydrophobicContact CD2-CG 4.23Å; Q253-P255 WeakPolarHBondContact O-CD 3.46Å; P255-P265 WeakPolarHBondContact O-CD 3.27Å; P255-L282 HydrophobicContact CB-CD2 4.15Å; P255-D285 WeakPolarHBondContact CG-O 3.18Å; P255-A287 HydrophobicContact CB-CB 4.09Å
256	N	89.7	Confident	91.7	Very high	22 Å²	22	31.9 Å²	31.9	12%	0.118	17%	0.166	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103.2	16.9	-176	-56.7	-57	0	0	0	113.2	N254 H286 A287 I288 T405	N254-N256 PolarHBondContact O-N 3.37Å; N254-N256 WeakPolarHBondContact OD1-CB 3.38Å; N254-N256 PolarHBondContact OD1-N 2.76Å; N256-H286 PolarHBondContact ND2-O 3.31Å; N256-H286 PolarHBondContact OD1-O 3.14Å; N256-A287 VanDerWaalsContact OD1-CA 3.3Å; N256-A287 WeakPolarHBondContact OD1-CA 3.32Å; N256-I288 WeakPolarHBondContact OD1-CG1 3.5Å; N256-I288 PolarHBondContact OD1-N 2.98Å; N256-T405 WeakPolarHBondContact ND2-CG2 3.16Å; N256-T405 PolarHBondContact ND2-OG1 3.22Å
257	V	87.6	Confident	91.7	Very high	20 Å²	20	29.3 Å²	29.3	12%	0.121	15%	0.153	C	C	.	.			trans	-65.6	143	168.9	179.7	0	0	0	0	109	T231 H234 N254 P265	T231-V257 HydrophobicContact CG2-CG1 3.77Å; H234-V257 PolarHBondContact CE1-O 3.21Å; H234-V257 VanDerWaalsContact CE1-O 3.28Å; H234-V257 PolarHBondContact NE2-O 2.86Å; N254-V257 HydrophobicContact CB-CG2 3.97Å; N254-V257 WeakPolarHBondContact O-CG2 3.11Å; V257-P265 WeakPolarHBondContact O-CD 3.39Å
258	R	88.7	Confident	91.6	Very high	66 Å²	66	30.6 Å²	30.6	25%	0.249	16%	0.158	C	C	.	.			trans	-111.7	156	177.3	-65.1	-178.2	174.5	-169.5	-7.7	113.5	Y14 R225 D262 L263 T264	Y14-R258 PolarHBondContact OH-NH1 3.27Å; R225-R258 PolarHBondContact NH2-O 3.12Å; R258-D262 VanDerWaalsContact CD-O 3.23Å; R258-D262 WeakPolarHBondContact CD-O 3.21Å; R258-D262 WeakPolarHBondContact CD-OD1 3.3Å; R258-D262 WeakPolarHBondContact CG-O 3.27Å; R258-D262 IonicContact CZ-OD1 3.24Å; R258-D262 PolarHBondContact NE-O 3.12Å; R258-D262 IonicContact NE-OD1 2.82Å; R258-D262 IonicContact NH1-OD1 2.66Å; R258-D262 PolarHBondContact NH1-OD1 3.35Å; R258-L263 VanDerWaalsContact CA-O 3.26Å; R258-L263 WeakPolarHBondContact CA-O 3.3Å; R258-T264 HydrophobicContact CG-CG2 4.13Å
259	D	90.7	Very high	91.6	Very high	10 Å²	10	30.6 Å²	30.6	5%	0.053	16%	0.158	C	C	.	.			trans	-96	-172.4	168.6	91.2	-33.2	0	0	0	112.4	M230 N261 D262 L263 Y268	M230-D259 HydrophobicContact CG-CB 4.26Å; D259-N261 PolarHBondContact O-N 3.26Å; D259-N261 WeakPolarHBondContact OD1-CA 3.26Å; D259-N261 WeakPolarHBondContact OD1-CB 3.33Å; D259-N261 PolarHBondContact OD1-N 3.38Å; D259-N261 PolarHBondContact OD2-ND2 2.89Å; D259-D262 WeakPolarHBondContact O-CA 3.49Å; D259-D262 PolarHBondContact O-N 3.44Å; D259-D262 PolarHBondContact OD1-N 3.26Å; D259-L263 PolarHBondContact N-O 3.43Å; D259-L263 VanDerWaalsContact N-O 3.09Å; D259-L263 PolarHBondContact OD1-N 3.45Å; D259-Y268 PolarHBondContact OD2-OH 3.05Å
260	K	89.5	Confident	91.6	Very high	112 Å²	112	30.3 Å²	30.3	49%	0.487	16%	0.156	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-13.8	176.2	61.3	-175.1	169.1	-173.3	0	115.5	D228 T229	D228-K260 VanDerWaalsContact O-CD 3.3Å; D228-K260 WeakPolarHBondContact O-CD 3.43Å; D228-K260 WeakPolarHBondContact O-CE 3.35Å; D228-K260 IonicContact OD1-NZ 3.17Å; D228-K260 PolarHBondContact OD1-NZ 2.75Å; T229-K260 HydrophobicContact CG2-CB 3.97Å; T229-K260 HydrophobicContact CG2-CD 4.35Å; T229-K260 HydrophobicContact CG2-CG 4.47Å; T229-K260 WeakPolarHBondContact OG1-CB 3.38Å; T229-K260 PolarHBondContact OG1-N 3.17Å
261	N	89.7	Confident	91.4	Very high	78 Å²	78	26.7 Å²	26.7	42%	0.417	14%	0.142	S	C	.	.	T	Hydrogen-bonded Turn	trans	-103.3	8.8	176	-49.9	-68.1	0	0	0	111	D259 L263	D259-N261 PolarHBondContact O-N 3.26Å; D259-N261 WeakPolarHBondContact OD1-CA 3.26Å; D259-N261 WeakPolarHBondContact OD1-CB 3.33Å; D259-N261 PolarHBondContact OD1-N 3.38Å; D259-N261 PolarHBondContact OD2-ND2 2.89Å; N261-L263 HydrophobicContact CB-CD1 3.93Å; N261-L263 HydrophobicContact CB-CG 3.84Å; N261-L263 PolarHBondContact O-N 3.4Å
262	D	88.4	Confident	91.3	Very high	56 Å²	56	28.6 Å²	28.6	30%	0.299	15%	0.15	S	C	.	.	S	Bend	trans	59.8	16	-169.4	-89.4	-75.2	0	0	0	115	Y14 R258 D259 V291	Y14-D262 HydrophobicContact CE2-CB 3.97Å; Y14-D262 VanDerWaalsContact CE2-OD2 3.3Å; Y14-D262 WeakPolarHBondContact CE2-OD2 3.45Å; R258-D262 VanDerWaalsContact CD-O 3.23Å; R258-D262 WeakPolarHBondContact CD-O 3.21Å; R258-D262 WeakPolarHBondContact CD-OD1 3.3Å; R258-D262 WeakPolarHBondContact CG-O 3.27Å; R258-D262 IonicContact CZ-OD1 3.24Å; R258-D262 PolarHBondContact NE-O 3.12Å; R258-D262 IonicContact NE-OD1 2.82Å; R258-D262 IonicContact NH1-OD1 2.66Å; R258-D262 PolarHBondContact NH1-OD1 3.35Å; D259-D262 WeakPolarHBondContact O-CA 3.49Å; D259-D262 PolarHBondContact O-N 3.44Å; D259-D262 PolarHBondContact OD1-N 3.26Å; D262-V291 VanDerWaalsContact O-CG1 3.31Å; D262-V291 WeakPolarHBondContact O-CG1 3.42Å
263	L	93.7	Very high	91.2	Very high	13 Å²	13	33 Å²	33	7%	0.068	16%	0.164	C	C	.	.			trans	-86.1	151.8	-177.3	-61.5	179.8	0	0	0	112.2	H234 R258 D259 N261 Y267 Y268 V291 D293	H234-L263 PolarHBondContact NE2-O 3.2Å; R258-L263 VanDerWaalsContact CA-O 3.26Å; R258-L263 WeakPolarHBondContact CA-O 3.3Å; D259-L263 PolarHBondContact N-O 3.43Å; D259-L263 VanDerWaalsContact N-O 3.09Å; D259-L263 PolarHBondContact OD1-N 3.45Å; N261-L263 HydrophobicContact CB-CD1 3.93Å; N261-L263 HydrophobicContact CB-CG 3.84Å; N261-L263 PolarHBondContact O-N 3.4Å; L263-Y267 HydrophobicContact CB-CD1 4.35Å; L263-Y267 HydrophobicContact CB-CG 4.42Å; L263-Y267 HydrophobicContact CD1-CD1 3.78Å; L263-Y267 HydrophobicContact CD1-CE1 3.91Å; L263-Y267 HydrophobicContact CD2-CD1 3.74Å; L263-Y267 HydrophobicContact CD2-CD2 3.94Å; L263-Y267 HydrophobicContact CD2-CE1 3.91Å; L263-Y267 HydrophobicContact CD2-CE2 4.1Å; L263-Y267 HydrophobicContact CD2-CG 3.75Å; L263-Y267 HydrophobicContact CG-CD1 4.16Å; L263-Y267 HydrophobicContact CG-CG 4.45Å; L263-Y268 HydrophobicContact CB-CE2 3.76Å; L263-Y268 HydrophobicContact CD1-CE2 4.31Å; L263-V291 HydrophobicContact CD2-CG1 4.37Å; L263-D293 HydrophobicContact CD2-CB 4.01Å
264	T	94.2	Very high	91	Very high	2 Å²	2	34 Å²	34	1%	0.012	17%	0.169	C	C	.	.			trans	-106.8	165	-178	60.1	0	0	0	0	112.3	R258 L266 Y267 Y268 I288 V291	R258-T264 HydrophobicContact CG-CG2 4.13Å; T264-L266 PolarHBondContact O-N 3.25Å; T264-Y267 VanDerWaalsContact O-CB 3.3Å; T264-Y267 WeakPolarHBondContact O-CB 3.36Å; T264-Y267 PolarHBondContact O-N 2.92Å; T264-Y267 PolarHBondContact OG1-N 2.92Å; T264-Y268 WeakPolarHBondContact O-CD2 3.34Å; T264-Y268 PolarHBondContact O-N 2.96Å; T264-I288 HydrophobicContact CG2-CD1 4.4Å; T264-I288 HydrophobicContact CG2-CG1 4.35Å; T264-V291 HydrophobicContact CG2-CG1 4.37Å; T264-V291 HydrophobicContact CG2-CG2 3.94Å
265	P	95.6	Very high	91.1	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-55.1	-34.5	170.5	-25.5	34.2	0	0	0	113.6	L233 H234 A237 P255 V257 Y267 A269 L282	L233-P265 HydrophobicContact CB-CG 4.44Å; L233-P265 HydrophobicContact CD2-CB 4.49Å; L233-P265 HydrophobicContact CD2-CG 4.1Å; L233-P265 HydrophobicContact CG-CB 4.05Å; L233-P265 HydrophobicContact CG-CG 3.92Å; H234-P265 WeakPolarHBondContact NE2-CD 3.33Å; A237-P265 HydrophobicContact CB-CB 4.02Å; A237-P265 VanDerWaalsContact CB-O 3.29Å; A237-P265 WeakPolarHBondContact CB-O 3.35Å; P255-P265 WeakPolarHBondContact O-CD 3.27Å; V257-P265 WeakPolarHBondContact O-CD 3.39Å; P265-Y267 VanDerWaalsContact C-N 3.35Å; P265-A269 VanDerWaalsContact O-CB 3.27Å; P265-A269 WeakPolarHBondContact O-CB 3.47Å; P265-A269 PolarHBondContact O-N 2.98Å; P265-L282 HydrophobicContact CB-CD2 4.26Å
266	L	95.6	Very high	91	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-65.1	-38.8	175.5	-176	68.7	0	0	0	111.8	T264 Y268 A269 C270 I279 L282 L283 A287 I288 L289 E299	T264-L266 PolarHBondContact O-N 3.25Å; L266-Y268 PolarHBondContact O-N 3.21Å; L266-A269 CarbonylContact O-C 3.53Å; L266-A269 WeakPolarHBondContact O-CB 3.39Å; L266-A269 PolarHBondContact O-N 2.82Å; L266-C270 PolarHBondContact O-N 2.7Å; L266-C270 PolarHBondContact O-SG 3.19Å; L266-I279 HydrophobicContact CD1-CG2 4.11Å; L266-L282 HydrophobicContact CD1-CB 4.08Å; L266-L282 HydrophobicContact CD1-CD1 4.36Å; L266-L283 HydrophobicContact CD1-CD2 4.19Å; L266-L283 HydrophobicContact CD1-CG 4.09Å; L266-L283 HydrophobicContact CD2-CD2 3.7Å; L266-L283 HydrophobicContact CD2-CG 4.48Å; L266-A287 HydrophobicContact CB-CB 4.13Å; L266-A287 HydrophobicContact CD2-CB 4.05Å; L266-I288 WeakPolarHBondContact CD2-O 3.31Å; L266-L289 HydrophobicContact CD2-CD2 3.85Å; L266-E299 HydrophobicContact CD2-CG 4.38Å; L266-E299 HydrophobicContact CG-CG 4.41Å
267	Y	95.6	Very high	91.1	Very high	5 Å²	5	42.6 Å²	42.6	2%	0.02	20%	0.204	C	C	.	.	H	α-helix	trans	-60.1	-48	177.4	-166.2	-87.8	0	0	0	112.3	L263 T264 P265 C270 S271 V291 D293 R297 E299 Q302	L263-Y267 HydrophobicContact CB-CD1 4.35Å; L263-Y267 HydrophobicContact CB-CG 4.42Å; L263-Y267 HydrophobicContact CD1-CD1 3.78Å; L263-Y267 HydrophobicContact CD1-CE1 3.91Å; L263-Y267 HydrophobicContact CD2-CD1 3.74Å; L263-Y267 HydrophobicContact CD2-CD2 3.94Å; L263-Y267 HydrophobicContact CD2-CE1 3.91Å; L263-Y267 HydrophobicContact CD2-CE2 4.1Å; L263-Y267 HydrophobicContact CD2-CG 3.75Å; L263-Y267 HydrophobicContact CG-CD1 4.16Å; L263-Y267 HydrophobicContact CG-CG 4.45Å; T264-Y267 VanDerWaalsContact O-CB 3.3Å; T264-Y267 WeakPolarHBondContact O-CB 3.36Å; T264-Y267 PolarHBondContact O-N 2.92Å; T264-Y267 PolarHBondContact OG1-N 2.92Å; P265-Y267 VanDerWaalsContact C-N 3.35Å; Y267-C270 PolarHBondContact O-N 2.84Å; Y267-C270 VanDerWaalsContact O-N 3.16Å; Y267-S271 PolarHBondContact O-N 3.47Å; Y267-S271 VanDerWaalsContact O-N 3.08Å; Y267-S271 PolarHBondContact O-OG 2.78Å; Y267-S271 VanDerWaalsContact O-OG 3.07Å; Y267-V291 WeakPolarHBondContact CD2-O 3.46Å; Y267-V291 WeakPolarHBondContact CE2-O 3.5Å; Y267-D293 HydrophobicContact CE1-CB 4.33Å; Y267-D293 VanDerWaalsContact OH-CB 3.31Å; Y267-D293 WeakPolarHBondContact OH-CB 3.28Å; Y267-D293 VanDerWaalsContact OH-CG 3.23Å; Y267-D293 PolarHBondContact OH-OD2 2.84Å; Y267-R297 WeakPolarHBondContact CE2-O 2.95Å; Y267-R297 PolarHBondContact OH-O 3.16Å; Y267-E299 HydrophobicContact CD2-CG 4.06Å; Y267-Q302 HydrophobicContact CE1-CG 4.04Å; Y267-Q302 HydrophobicContact CE2-CG 4.13Å; Y267-Q302 WeakPolarHBondContact OH-CG 3.39Å; Y267-Q302 PolarHBondContact OH-NE2 2.85Å
268	Y	94.9	Very high	91.5	Very high	30 Å²	30	41.6 Å²	41.6	12%	0.118	20%	0.199	C	C	.	.	H	α-helix	trans	-64.5	-40.2	175.4	-73.5	-73.6	0	0	0	111.8	M230 H234 I238 D259 L263 T264 L266 C270 S271 E272	M230-Y268 HydrophobicContact CE-CE1 3.95Å; M230-Y268 HydrophobicContact CE-CE2 3.86Å; M230-Y268 VanDerWaalsContact CE-CZ 3.44Å; M230-Y268 VanDerWaalsContact CE-OH 3.3Å; M230-Y268 WeakPolarHBondContact CE-OH 3.38Å; H234-Y268 AromaticContact CD2-CD2 3.98Å; I238-Y268 HydrophobicContact CD1-CD1 4.03Å; I238-Y268 HydrophobicContact CD1-CE1 4.49Å; I238-Y268 HydrophobicContact CD1-CG 4.13Å; I238-Y268 HydrophobicContact CG1-CD1 3.89Å; I238-Y268 HydrophobicContact CG1-CG 3.86Å; D259-Y268 PolarHBondContact OD2-OH 3.05Å; L263-Y268 HydrophobicContact CB-CE2 3.76Å; L263-Y268 HydrophobicContact CD1-CE2 4.31Å; T264-Y268 WeakPolarHBondContact O-CD2 3.34Å; T264-Y268 PolarHBondContact O-N 2.96Å; L266-Y268 PolarHBondContact O-N 3.21Å; Y268-C270 PolarHBondContact O-N 3.08Å; Y268-S271 PolarHBondContact O-N 2.81Å; Y268-E272 PolarHBondContact O-N 3.35Å
269	A	94.6	Very high	91.8	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-61.1	-23.8	173.4	0	0	0	0	0	113.9	A237 P265 L266 I274 I279 L282	A237-A269 HydrophobicContact CB-CB 4.27Å; P265-A269 VanDerWaalsContact O-CB 3.27Å; P265-A269 WeakPolarHBondContact O-CB 3.47Å; P265-A269 PolarHBondContact O-N 2.98Å; L266-A269 CarbonylContact O-C 3.53Å; L266-A269 WeakPolarHBondContact O-CB 3.39Å; L266-A269 PolarHBondContact O-N 2.82Å; A269-I274 HydrophobicContact CB-CD1 3.69Å; A269-I274 WeakPolarHBondContact O-CG1 3.38Å; A269-I279 HydrophobicContact CB-CG1 3.99Å; A269-I279 WeakPolarHBondContact O-CD1 3.3Å; A269-L282 HydrophobicContact CB-CD1 3.89Å
270	C	93.4	Very high	91.9	Very high	0 Å²	0	43 Å²	43	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-92.6	-12.4	173.2	-63.4	0	0	0	0	113.9	L266 Y267 Y268 E299 Q302 R308 T311	L266-C270 PolarHBondContact O-N 2.7Å; L266-C270 PolarHBondContact O-SG 3.19Å; Y267-C270 PolarHBondContact O-N 2.84Å; Y267-C270 VanDerWaalsContact O-N 3.16Å; Y268-C270 PolarHBondContact O-N 3.08Å; C270-E299 HydrophobicContact CB-CB 4.13Å; C270-Q302 HydrophobicContact CB-CB 4.42Å; C270-R308 PolarHBondContact O-NH1 2.95Å; C270-T311 HydrophobicContact CB-CG2 4.38Å
271	S	90.2	Very high	92.2	Very high	23 Å²	23	39.4 Å²	39.4	16%	0.161	19%	0.191	C	C	.	.	H	α-helix	trans	-93.8	-41.6	176.6	-59.8	0	0	0	0	112.8	Y267 Y268 N306 R308	Y267-S271 PolarHBondContact O-N 3.47Å; Y267-S271 VanDerWaalsContact O-N 3.08Å; Y267-S271 PolarHBondContact O-OG 2.78Å; Y267-S271 VanDerWaalsContact O-OG 3.07Å; Y268-S271 PolarHBondContact O-N 2.81Å; S271-N306 PolarHBondContact O-ND2 3.41Å; S271-R308 PolarHBondContact O-NH1 3.29Å; S271-R308 PolarHBondContact O-NH2 2.84Å
272	E	88.4	Confident	92.4	Very high	85 Å²	85	35.7 Å²	35.7	40%	0.397	17%	0.171	S	C	.	.	S	Bend	trans	-82.7	152.2	179.6	-58.9	-50.2	142.2	0	0	113.2	I238 Y268 I274 R308	I238-E272 HydrophobicContact CG2-CG 4.31Å; Y268-E272 PolarHBondContact O-N 3.35Å; E272-I274 VanDerWaalsContact C-N 3.28Å; E272-I274 HydrophobicContact CB-CG2 3.8Å; E272-I274 PolarHBondContact O-N 3.03Å; E272-R308 VanDerWaalsContact C-CZ 3.43Å; E272-R308 VanDerWaalsContact C-NH2 3.26Å; E272-R308 PolarHBondContact O-NH1 2.88Å; E272-R308 PolarHBondContact O-NH2 3.03Å
273	D	86.1	Confident	92.6	Very high	136 Å²	136	33 Å²	33	73%	0.727	16%	0.157	S	C	*	.			trans	-82.7	72.9	-175.8	-156.5	47.7	0	0	0	112.4	R308	D273-R308 VanDerWaalsContact CA-NH2 3.3Å; D273-R308 VanDerWaalsContact N-NH2 3.2Å; D273-R308 IonicContact OD1-CZ 3Å; D273-R308 IonicContact OD1-NE 3.74Å; D273-R308 PolarHBondContact OD1-NE 2.93Å; D273-R308 IonicContact OD1-NH2 2.66Å; D273-R308 PolarHBondContact OD1-NH2 3.34Å
274	I	87	Confident	92.6	Very high	26 Å²	26	36 Å²	36	13%	0.133	17%	0.168	C	C	.	.			trans	-114.6	167.6	-169.9	70	161.7	0	0	0	113.3	A237 G240 A269 E272 C278 I279	A237-I274 WeakPolarHBondContact O-CD1 3.05Å; G240-I274 VanDerWaalsContact CA-CG2 3.44Å; A269-I274 HydrophobicContact CB-CD1 3.69Å; A269-I274 WeakPolarHBondContact O-CG1 3.38Å; E272-I274 VanDerWaalsContact C-N 3.28Å; E272-I274 HydrophobicContact CB-CG2 3.8Å; E272-I274 PolarHBondContact O-N 3.03Å; I274-C278 HydrophobicContact CD1-CB 3.67Å; I274-I279 HydrophobicContact CG1-CD1 4.46Å
275	R	88.2	Confident	92.4	Very high	118 Å²	118	36 Å²	36	45%	0.445	17%	0.168	S	C	.	.			trans	-57.5	127.6	175.4	-90.9	-168.8	-62	144.8	-2.3	112.9	G240 F242 E277 C278	G240-R275 PolarHBondContact O-NH2 3.17Å; F242-R275 VanDerWaalsContact CB-NH2 3.31Å; R275-E277 WeakPolarHBondContact CB-OE2 3.34Å; R275-E277 PolarHBondContact O-N 2.79Å; R275-E277 VanDerWaalsContact O-N 3.13Å; R275-C278 VanDerWaalsContact O-CB 3.26Å; R275-C278 WeakPolarHBondContact O-CB 3.39Å; R275-C278 PolarHBondContact O-N 2.89Å; R275-C278 PolarHBondContact O-SG 3.14Å; R275-C278 VanDerWaalsContact O-SG 3.42Å
276	P	88.9	Confident	92.1	Very high	29 Å²	29	36 Å²	36	19%	0.188	17%	0.168	C	C	.	.	H	α-helix	trans	-64.3	-17.7	179.8	29	-36.3	0	0	0	113.1	C278 I279 Q280 K310 Q314	P276-C278 PolarHBondContact O-N 2.99Å; P276-I279 PolarHBondContact O-N 3.48Å; P276-Q280 PolarHBondContact O-N 3.11Å; P276-K310 HydrophobicContact CB-CB 4.39Å; P276-Q314 PolarHBondContact O-NE2 2.85Å; P276-Q314 PolarHBondContact O-OE1 2.84Å; P276-Q314 VanDerWaalsContact O-OE1 3.1Å
277	E	92.7	Very high	91.8	Very high	85 Å²	85	36 Å²	36	40%	0.397	17%	0.168	S	C	.	.	H	α-helix	trans	-61.8	-31.2	171.5	-60.4	75.2	-163.5	0	0	111.7	F242 R275 Q280 R281	F242-E277 HydrophobicContact CD2-CB 3.64Å; F242-E277 HydrophobicContact CE2-CB 3.72Å; F242-E277 WeakPolarHBondContact CE2-O 3.41Å; R275-E277 WeakPolarHBondContact CB-OE2 3.34Å; R275-E277 PolarHBondContact O-N 2.79Å; R275-E277 VanDerWaalsContact O-N 3.13Å; E277-Q280 PolarHBondContact O-N 2.89Å; E277-R281 WeakPolarHBondContact O-CB 3.26Å; E277-R281 PolarHBondContact O-N 2.85Å
278	C	95.4	Very high	91.5	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-66.1	-46.1	178.2	-57.7	0	0	0	0	111.5	G240 I245 I274 R275 P276 R281 L282	G240-C278 PolarHBondContact O-SG 3.19Å; G240-C278 VanDerWaalsContact O-SG 3.42Å; I245-C278 HydrophobicContact CD1-CB 3.61Å; I274-C278 HydrophobicContact CD1-CB 3.67Å; R275-C278 VanDerWaalsContact O-CB 3.26Å; R275-C278 WeakPolarHBondContact O-CB 3.39Å; R275-C278 PolarHBondContact O-N 2.89Å; R275-C278 PolarHBondContact O-SG 3.14Å; R275-C278 VanDerWaalsContact O-SG 3.42Å; P276-C278 PolarHBondContact O-N 2.99Å; C278-R281 PolarHBondContact O-N 3.43Å; C278-L282 WeakPolarHBondContact O-CG 3.14Å; C278-L282 PolarHBondContact O-N 2.93Å; C278-L282 VanDerWaalsContact O-N 3.13Å
279	I	94.7	Very high	91.3	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-61.9	-46.1	175	-67.5	135	0	0	0	109.8	L266 A269 I274 P276 R281 L282 L283 T311 Q314	L266-I279 HydrophobicContact CD1-CG2 4.11Å; A269-I279 HydrophobicContact CB-CG1 3.99Å; A269-I279 WeakPolarHBondContact O-CD1 3.3Å; I274-I279 HydrophobicContact CG1-CD1 4.46Å; P276-I279 PolarHBondContact O-N 3.48Å; I279-R281 PolarHBondContact O-N 3.2Å; I279-L282 PolarHBondContact O-N 3.21Å; I279-L283 HydrophobicContact CG2-CD1 3.7Å; I279-L283 HydrophobicContact CG2-CG 4.35Å; I279-L283 WeakPolarHBondContact O-CB 3.31Å; I279-L283 VanDerWaalsContact O-CG 3.32Å; I279-L283 WeakPolarHBondContact O-CG 3.3Å; I279-L283 PolarHBondContact O-N 2.93Å; I279-T311 HydrophobicContact CD1-CG2 3.55Å; I279-T311 WeakPolarHBondContact CD1-OG1 3.4Å; I279-T311 HydrophobicContact CG1-CG2 4.17Å; I279-T311 HydrophobicContact CG2-CG2 4.34Å; I279-Q314 HydrophobicContact CG2-CB 4.34Å
280	Q	93.1	Very high	91	Very high	106 Å²	106	39.3 Å²	39.3	50%	0.495	19%	0.194	S	C	.	.	H	α-helix	trans	-59.9	-41.3	176.5	-174.2	170.3	-23.7	0	0	113	P276 E277 Y284	P276-Q280 PolarHBondContact O-N 3.11Å; E277-Q280 PolarHBondContact O-N 2.89Å; Q280-Y284 WeakPolarHBondContact O-CB 3.38Å; Q280-Y284 PolarHBondContact O-N 3.26Å
281	R	94.8	Very high	90.9	Very high	35 Å²	35	39.5 Å²	39.5	13%	0.132	20%	0.196	C	C	.	.	H	α-helix	trans	-64.9	-41.6	178.7	-163.6	73.8	-178.5	70	9.2	111.6	F242 I245 E246 L249 E277 C278 I279 D285	F242-R281 HydrophobicContact CD2-CB 4.4Å; F242-R281 HydrophobicContact CE2-CB 3.87Å; F242-R281 HydrophobicContact CE2-CG 4.18Å; F242-R281 HydrophobicContact CZ-CG 4.47Å; I245-R281 HydrophobicContact CG2-CB 4.32Å; I245-R281 HydrophobicContact CG2-CG 4.24Å; E246-R281 IonicContact OE1-CZ 2.7Å; E246-R281 IonicContact OE1-NE 2.92Å; E246-R281 PolarHBondContact OE1-NE 2.92Å; E246-R281 IonicContact OE1-NH2 3.76Å; L249-R281 HydrophobicContact CD1-CG 4.16Å; E277-R281 WeakPolarHBondContact O-CB 3.26Å; E277-R281 PolarHBondContact O-N 2.85Å; C278-R281 PolarHBondContact O-N 3.43Å; I279-R281 PolarHBondContact O-N 3.2Å; R281-D285 IonicContact CZ-OD2 3.85Å; R281-D285 IonicContact NH1-OD1 3.79Å; R281-D285 IonicContact NH1-OD2 2.93Å; R281-D285 PolarHBondContact NH1-OD2 3.17Å; R281-D285 IonicContact NH2-OD2 3.93Å; R281-D285 PolarHBondContact O-N 2.79Å
282	L	94.5	Very high	91	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-65.2	-48.8	175.9	-73.7	164.8	0	0	0	111.9	L233 I245 L249 P255 P265 L266 A269 C278 I279 D285 H286 A287	L233-L282 HydrophobicContact CD1-CD2 4.34Å; L233-L282 HydrophobicContact CD2-CD2 4.41Å; I245-L282 HydrophobicContact CG2-CD2 4.22Å; I245-L282 HydrophobicContact CG2-CG 4.11Å; L249-L282 HydrophobicContact CD1-CD2 4.2Å; P255-L282 HydrophobicContact CB-CD2 4.15Å; P265-L282 HydrophobicContact CB-CD2 4.26Å; L266-L282 HydrophobicContact CD1-CB 4.08Å; L266-L282 HydrophobicContact CD1-CD1 4.36Å; A269-L282 HydrophobicContact CB-CD1 3.89Å; C278-L282 WeakPolarHBondContact O-CG 3.14Å; C278-L282 PolarHBondContact O-N 2.93Å; C278-L282 VanDerWaalsContact O-N 3.13Å; I279-L282 PolarHBondContact O-N 3.21Å; L282-D285 CarbonylContact O-C 3.53Å; L282-D285 PolarHBondContact O-N 3.46Å; L282-H286 PolarHBondContact O-N 2.76Å; L282-A287 HydrophobicContact CB-CB 3.98Å; L282-A287 WeakPolarHBondContact O-CB 3.29Å; L282-A287 PolarHBondContact O-N 3.38Å
283	L	93.2	Very high	91.2	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-62.1	-44	178.8	-71.2	171.2	0	0	0	112.2	L266 I279 D285 H286 L289 Q314 L315 Y318	L266-L283 HydrophobicContact CD1-CD2 4.19Å; L266-L283 HydrophobicContact CD1-CG 4.09Å; L266-L283 HydrophobicContact CD2-CD2 3.7Å; L266-L283 HydrophobicContact CD2-CG 4.48Å; I279-L283 HydrophobicContact CG2-CD1 3.7Å; I279-L283 HydrophobicContact CG2-CG 4.35Å; I279-L283 WeakPolarHBondContact O-CB 3.31Å; I279-L283 VanDerWaalsContact O-CG 3.32Å; I279-L283 WeakPolarHBondContact O-CG 3.3Å; I279-L283 PolarHBondContact O-N 2.93Å; L283-D285 PolarHBondContact O-N 3.43Å; L283-H286 PolarHBondContact O-N 3.34Å; L283-L289 HydrophobicContact CD2-CD1 4.43Å; L283-L289 HydrophobicContact CD2-CD2 3.96Å; L283-L289 HydrophobicContact CD2-CG 4.19Å; L283-Q314 HydrophobicContact CD1-CB 4.12Å; L283-L315 HydrophobicContact CD1-CD2 4.36Å; L283-Y318 HydrophobicContact CB-CD1 3.8Å; L283-Y318 HydrophobicContact CB-CD2 3.97Å; L283-Y318 HydrophobicContact CB-CE1 3.71Å; L283-Y318 HydrophobicContact CB-CE2 3.87Å; L283-Y318 HydrophobicContact CB-CG 3.91Å; L283-Y318 HydrophobicContact CD1-CD2 3.77Å; L283-Y318 HydrophobicContact CD1-CE2 4.14Å; L283-Y318 HydrophobicContact CD1-CG 4.1Å; L283-Y318 HydrophobicContact CD2-CG 4.24Å; L283-Y318 HydrophobicContact CG-CD2 4.37Å; L283-Y318 HydrophobicContact CG-CG 4.32Å; L283-Y318 WeakPolarHBondContact O-CE1 3.46Å
284	Y	92.7	Very high	91.5	Very high	77 Å²	77	36.5 Å²	36.5	30%	0.302	18%	0.183	S	C	.	.	H	α-helix	trans	-56.2	-38.9	173.9	174.7	-94.3	0	0	0	111.8	Q280 H286 V397 Y398 N399	Q280-Y284 WeakPolarHBondContact O-CB 3.38Å; Q280-Y284 PolarHBondContact O-N 3.26Å; Y284-H286 PolarHBondContact O-N 2.98Å; Y284-V397 HydrophobicContact CD2-CG1 4.25Å; Y284-V397 VanDerWaalsContact CD2-O 3.25Å; Y284-V397 WeakPolarHBondContact CD2-O 3.26Å; Y284-V397 HydrophobicContact CE2-CG1 4Å; Y284-Y398 WeakPolarHBondContact O-CA 3.48Å; Y284-N399 HydrophobicContact CD1-CB 3.78Å; Y284-N399 HydrophobicContact CE1-CB 3.41Å; Y284-N399 VanDerWaalsContact CE1-CB 3.41Å; Y284-N399 PolarHBondContact O-N 2.78Å
285	D	90.9	Very high	91.7	Very high	1 Å²	1	39.6 Å²	39.6	1%	0.005	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.8	20.7	176.5	-84.6	-29.6	0	0	0	115.1	L249 P255 R281 L282 L283 N399 R402	L249-D285 VanDerWaalsContact CB-OD2 3.23Å; L249-D285 WeakPolarHBondContact CB-OD2 3.4Å; L249-D285 HydrophobicContact CD1-CB 4.2Å; L249-D285 WeakPolarHBondContact CD1-OD2 3.27Å; L249-D285 HydrophobicContact CD2-CB 4.26Å; P255-D285 WeakPolarHBondContact CG-O 3.18Å; R281-D285 IonicContact CZ-OD2 3.85Å; R281-D285 IonicContact NH1-OD1 3.79Å; R281-D285 IonicContact NH1-OD2 2.93Å; R281-D285 PolarHBondContact NH1-OD2 3.17Å; R281-D285 IonicContact NH2-OD2 3.93Å; R281-D285 PolarHBondContact O-N 2.79Å; L282-D285 CarbonylContact O-C 3.53Å; L282-D285 PolarHBondContact O-N 3.46Å; L283-D285 PolarHBondContact O-N 3.43Å; D285-N399 WeakPolarHBondContact OD1-CB 3.25Å; D285-N399 PolarHBondContact OD1-ND2 2.82Å; D285-R402 WeakPolarHBondContact O-CD 3.4Å; D285-R402 IonicContact OD1-NE 2.68Å
286	H	88.1	Confident	91.8	Very high	1 Å²	1	34.7 Å²	34.7	1%	0.005	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	69.4	37.1	175.2	-44.1	-100.3	0	0	0	114.2	N256 L282 L283 Y284 I288 Y398 N399 P409 R410	N256-H286 PolarHBondContact ND2-O 3.31Å; N256-H286 PolarHBondContact OD1-O 3.14Å; L282-H286 PolarHBondContact O-N 2.76Å; L283-H286 PolarHBondContact O-N 3.34Å; Y284-H286 PolarHBondContact O-N 2.98Å; H286-I288 PolarHBondContact O-N 3.12Å; H286-Y398 AromaticContact ND1-CD1 3.78Å; H286-N399 PolarHBondContact NE2-O 2.94Å; H286-P409 WeakPolarHBondContact O-CD 3.49Å; H286-R410 WeakPolarHBondContact ND1-CB 3.38Å
287	A	91.2	Very high	92.1	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	18%	0.183	C	C	.	.			trans	-66.4	123.4	166.8	0	0	0	0	0	111.5	P255 N256 L266 L282 P409	P255-A287 HydrophobicContact CB-CB 4.09Å; N256-A287 VanDerWaalsContact OD1-CA 3.3Å; N256-A287 WeakPolarHBondContact OD1-CA 3.32Å; L266-A287 HydrophobicContact CB-CB 4.13Å; L266-A287 HydrophobicContact CD2-CB 4.05Å; L282-A287 HydrophobicContact CB-CB 3.98Å; L282-A287 WeakPolarHBondContact O-CB 3.29Å; L282-A287 PolarHBondContact O-N 3.38Å; A287-P409 WeakPolarHBondContact O-CG 3.49Å
288	I	87.9	Confident	92.2	Very high	32 Å²	32	34 Å²	34	16%	0.164	17%	0.172	C	C	.	.			trans	-62.6	147.7	-178.9	60	178.4	0	0	0	112.5	N256 T264 L266 H286 V291	N256-I288 WeakPolarHBondContact OD1-CG1 3.5Å; N256-I288 PolarHBondContact OD1-N 2.98Å; T264-I288 HydrophobicContact CG2-CD1 4.4Å; T264-I288 HydrophobicContact CG2-CG1 4.35Å; L266-I288 WeakPolarHBondContact CD2-O 3.31Å; H286-I288 PolarHBondContact O-N 3.12Å; I288-V291 HydrophobicContact CD1-CG2 3.64Å; I288-V291 HydrophobicContact CG1-CG2 3.73Å
289	L	90.3	Very high	92.2	Very high	40 Å²	40	34 Å²	34	21%	0.209	17%	0.172	C	C	.	.	S	Bend	trans	-107.6	156.6	173.1	-70.8	168.3	0	0	0	110.1	L266 L283 L315 Y318 A320	L266-L289 HydrophobicContact CD2-CD2 3.85Å; L283-L289 HydrophobicContact CD2-CD1 4.43Å; L283-L289 HydrophobicContact CD2-CD2 3.96Å; L283-L289 HydrophobicContact CD2-CG 4.19Å; L289-L315 HydrophobicContact CD2-CD2 3.5Å; L289-L315 VanDerWaalsContact CD2-CD2 3.5Å; L289-Y318 WeakPolarHBondContact CD1-O 3.42Å; L289-A320 HydrophobicContact CD1-CB 4.23Å; L289-A320 HydrophobicContact CD2-CB 4.48Å
290	G	90	Very high	92.2	Very high	31 Å²	31	34 Å²	34	32%	0.32	17%	0.173	S	C	.	.			trans	90	14.8	176.6	0	0	0	0	0	114.3	T292 E299	G290-T292 PolarHBondContact O-N 3.2Å; G290-E299 WeakPolarHBondContact CA-OE2 3Å; G290-E299 PolarHBondContact N-OE1 2.98Å; G290-E299 PolarHBondContact N-OE2 2.9Å
291	V	90.1	Very high	92.4	Very high	5 Å²	5	29 Å²	29	3%	0.03	15%	0.149	C	C	.	.			trans	-75.9	121.6	176.4	-177	0	0	0	0	109.5	D262 L263 T264 Y267 I288 Q298 E299	D262-V291 VanDerWaalsContact O-CG1 3.31Å; D262-V291 WeakPolarHBondContact O-CG1 3.42Å; L263-V291 HydrophobicContact CD2-CG1 4.37Å; T264-V291 HydrophobicContact CG2-CG1 4.37Å; T264-V291 HydrophobicContact CG2-CG2 3.94Å; Y267-V291 WeakPolarHBondContact CD2-O 3.46Å; Y267-V291 WeakPolarHBondContact CE2-O 3.5Å; I288-V291 HydrophobicContact CD1-CG2 3.64Å; I288-V291 HydrophobicContact CG1-CG2 3.73Å; V291-Q298 WeakPolarHBondContact O-CA 3.26Å; V291-E299 WeakPolarHBondContact CB-OE1 3.32Å; V291-E299 PolarHBondContact N-OE1 3.49Å; V291-E299 PolarHBondContact N-OE2 3.45Å
292	T	93.1	Very high	92.3	Very high	51 Å²	51	28 Å²	28	31%	0.313	15%	0.146	S	C	.	.			trans	-97.3	142.7	-176.2	50.7	0	0	0	0	112.8	G290 R297 Q298	G290-T292 PolarHBondContact O-N 3.2Å; T292-R297 WeakPolarHBondContact CA-O 3.48Å; T292-Q298 HydrophobicContact CG2-CG 3.65Å
293	D	93.2	Very high	92.4	Very high	16 Å²	16	28 Å²	28	9%	0.086	15%	0.146	C	C	.	.			trans	-82	-171.4	166.1	73.9	-5.6	0	0	0	113.8	L263 Y267 K295 G296 R297	L263-D293 HydrophobicContact CD2-CB 4.01Å; Y267-D293 HydrophobicContact CE1-CB 4.33Å; Y267-D293 VanDerWaalsContact OH-CB 3.31Å; Y267-D293 WeakPolarHBondContact OH-CB 3.28Å; Y267-D293 VanDerWaalsContact OH-CG 3.23Å; Y267-D293 PolarHBondContact OH-OD2 2.84Å; D293-K295 PolarHBondContact O-N 3.38Å; D293-K295 PolarHBondContact OD1-N 2.86Å; D293-G296 PolarHBondContact O-N 3.39Å; D293-G296 PolarHBondContact OD1-N 3Å; D293-R297 PolarHBondContact N-O 3.24Å; D293-R297 VanDerWaalsContact N-O 3.12Å; D293-R297 VanDerWaalsContact OD1-CB 3.26Å; D293-R297 WeakPolarHBondContact OD1-CB 3.42Å; D293-R297 PolarHBondContact OD1-N 2.84Å; D293-R297 IonicContact OD1-NE 3.18Å; D293-R297 IonicContact OD2-CZ 2.76Å; D293-R297 IonicContact OD2-NE 2.86Å; D293-R297 PolarHBondContact OD2-NE 3.32Å; D293-R297 IonicContact OD2-NH2 3.88Å; D293-R297 PolarHBondContact OD2-NH2 3.03Å
294	D	91.8	Very high	92.5	Very high	114 Å²	114	28 Å²	28	61%	0.61	15%	0.146	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.5	-0.5	177.3	75.9	-39.4	0	0	0	115.6
295	K	90.8	Very high	92.6	Very high	91 Å²	91	25.9 Å²	25.9	40%	0.396	14%	0.14	S	C	.	.	T	Hydrogen-bonded Turn	trans	-129	13.3	177.7	-68.6	150.1	-164.8	112.8	0	112.7	D293 R297 E327	D293-K295 PolarHBondContact O-N 3.38Å; D293-K295 PolarHBondContact OD1-N 2.86Å; K295-R297 VanDerWaalsContact C-N 3.27Å; K295-R297 HydrophobicContact CB-CG 4.14Å; K295-R297 PolarHBondContact O-N 2.83Å; K295-E327 WeakPolarHBondContact CA-OE2 3.36Å; K295-E327 PolarHBondContact O-N 2.88Å
296	G	91.4	Very high	92.6	Very high	14 Å²	14	28.9 Å²	28.9	14%	0.144	16%	0.156	C	C	.	.	S	Bend	trans	72.6	12.6	-175.9	0	0	0	0	0	114.4	D293 Q298	D293-G296 PolarHBondContact O-N 3.39Å; D293-G296 PolarHBondContact OD1-N 3Å; G296-Q298 PolarHBondContact O-N 3.12Å
297	R	94.4	Very high	92.8	Very high	65 Å²	65	29.7 Å²	29.7	25%	0.245	16%	0.164	C	C	.	.			trans	-82.5	116.3	-177.3	-56.8	-179	-67.4	170.5	1.6	110	Y267 T292 D293 K295 H301 Q302 V326	Y267-R297 WeakPolarHBondContact CE2-O 2.95Å; Y267-R297 PolarHBondContact OH-O 3.16Å; T292-R297 WeakPolarHBondContact CA-O 3.48Å; D293-R297 PolarHBondContact N-O 3.24Å; D293-R297 VanDerWaalsContact N-O 3.12Å; D293-R297 VanDerWaalsContact OD1-CB 3.26Å; D293-R297 WeakPolarHBondContact OD1-CB 3.42Å; D293-R297 PolarHBondContact OD1-N 2.84Å; D293-R297 IonicContact OD1-NE 3.18Å; D293-R297 IonicContact OD2-CZ 2.76Å; D293-R297 IonicContact OD2-NE 2.86Å; D293-R297 PolarHBondContact OD2-NE 3.32Å; D293-R297 IonicContact OD2-NH2 3.88Å; D293-R297 PolarHBondContact OD2-NH2 3.03Å; K295-R297 VanDerWaalsContact C-N 3.27Å; K295-R297 HydrophobicContact CB-CG 4.14Å; K295-R297 PolarHBondContact O-N 2.83Å; R297-H301 HydrophobicContact CB-CB 4.08Å; R297-Q302 VanDerWaalsContact CZ-NE2 3.33Å; R297-V326 HydrophobicContact CB-CG1 4.44Å; R297-V326 HydrophobicContact CG-CB 4.37Å; R297-V326 HydrophobicContact CG-CG1 3.85Å
298	Q	95.1	Very high	92.8	Very high	34 Å²	34	31.1 Å²	31.1	16%	0.159	17%	0.17	C	C	.	.			trans	-78.6	173.2	171.1	-59.2	178.9	-1.9	0	0	113	V291 T292 G296 I300 H301 Q302 A324	V291-Q298 WeakPolarHBondContact O-CA 3.26Å; T292-Q298 HydrophobicContact CG2-CG 3.65Å; G296-Q298 PolarHBondContact O-N 3.12Å; Q298-I300 VanDerWaalsContact C-N 3.26Å; Q298-I300 HydrophobicContact CB-CG2 4.12Å; Q298-I300 PolarHBondContact O-N 3.31Å; Q298-H301 PolarHBondContact N-ND1 2.92Å; Q298-H301 VanDerWaalsContact N-ND1 3.19Å; Q298-H301 WeakPolarHBondContact O-CA 3.34Å; Q298-H301 VanDerWaalsContact O-CB 3.31Å; Q298-H301 WeakPolarHBondContact O-CB 3.27Å; Q298-H301 PolarHBondContact O-N 3.01Å; Q298-Q302 PolarHBondContact O-N 3.28Å; Q298-A324 VanDerWaalsContact OE1-CB 3.32Å
299	E	94.8	Very high	93.1	Very high	1 Å²	1	30.7 Å²	30.7	1%	0.005	17%	0.169	C	C	.	.	H	α-helix	trans	-57.2	-38.9	179.7	-48.6	82.8	172.6	0	0	112.1	L266 Y267 C270 G290 V291 H301 Q302 A303 L315	L266-E299 HydrophobicContact CD2-CG 4.38Å; L266-E299 HydrophobicContact CG-CG 4.41Å; Y267-E299 HydrophobicContact CD2-CG 4.06Å; C270-E299 HydrophobicContact CB-CB 4.13Å; G290-E299 WeakPolarHBondContact CA-OE2 3Å; G290-E299 PolarHBondContact N-OE1 2.98Å; G290-E299 PolarHBondContact N-OE2 2.9Å; V291-E299 WeakPolarHBondContact CB-OE1 3.32Å; V291-E299 PolarHBondContact N-OE1 3.49Å; V291-E299 PolarHBondContact N-OE2 3.45Å; E299-H301 VanDerWaalsContact C-N 3.29Å; E299-H301 PolarHBondContact O-N 2.95Å; E299-Q302 PolarHBondContact O-N 3.45Å; E299-A303 PolarHBondContact O-N 3.49Å; E299-L315 HydrophobicContact CB-CD1 4.17Å; E299-L315 HydrophobicContact CB-CD2 4.26Å
300	I	95.7	Very high	93.2	Very high	1 Å²	1	36 Å²	36	1%	0.005	19%	0.191	C	C	.	.	H	α-helix	trans	-60.9	-36.8	175.4	-169.4	170.5	0	0	0	112.2	Q298 A303 C304 L312 A320 L322 P332 L348	Q298-I300 VanDerWaalsContact C-N 3.26Å; Q298-I300 HydrophobicContact CB-CG2 4.12Å; Q298-I300 PolarHBondContact O-N 3.31Å; I300-A303 PolarHBondContact O-N 2.65Å; I300-C304 WeakPolarHBondContact O-CB 3.32Å; I300-C304 PolarHBondContact O-N 2.75Å; I300-C304 VanDerWaalsContact O-N 3.08Å; I300-C304 PolarHBondContact O-SG 3.07Å; I300-L312 HydrophobicContact CD1-CD1 4.17Å; I300-L312 HydrophobicContact CG1-CD1 3.54Å; I300-A320 HydrophobicContact CB-CB 4.4Å; I300-A320 HydrophobicContact CD1-CB 4.17Å; I300-L322 HydrophobicContact CD1-CD2 4.11Å; I300-P332 HydrophobicContact CD1-CG 4.11Å; I300-P332 HydrophobicContact CG1-CB 4.36Å; I300-P332 HydrophobicContact CG1-CG 4.08Å; I300-P332 HydrophobicContact CG2-CG 4.03Å; I300-L348 HydrophobicContact CD1-CD2 4.2Å
301	H	95.9	Very high	93.4	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-69.7	-36.9	176.7	-63.9	98.2	0	0	0	111.4	R297 Q298 E299 C304 L305 A324 V326 P332 L335	R297-H301 HydrophobicContact CB-CB 4.08Å; Q298-H301 PolarHBondContact N-ND1 2.92Å; Q298-H301 VanDerWaalsContact N-ND1 3.19Å; Q298-H301 WeakPolarHBondContact O-CA 3.34Å; Q298-H301 VanDerWaalsContact O-CB 3.31Å; Q298-H301 WeakPolarHBondContact O-CB 3.27Å; Q298-H301 PolarHBondContact O-N 3.01Å; E299-H301 VanDerWaalsContact C-N 3.29Å; E299-H301 PolarHBondContact O-N 2.95Å; H301-C304 PolarHBondContact O-N 3.34Å; H301-L305 WeakPolarHBondContact O-CB 3.48Å; H301-L305 VanDerWaalsContact O-CG 3.29Å; H301-L305 WeakPolarHBondContact O-CG 3.27Å; H301-L305 PolarHBondContact O-N 3.45Å; H301-A324 PolarHBondContact NE2-O 2.77Å; H301-V326 VanDerWaalsContact CD2-CG1 3.44Å; H301-V326 WeakPolarHBondContact CD2-CG1 3.15Å; H301-P332 WeakPolarHBondContact NE2-CD 3.23Å; H301-L335 HydrophobicContact CB-CD1 3.62Å; H301-L335 VanDerWaalsContact CD2-CD1 3.49Å; H301-L335 WeakPolarHBondContact CD2-CD1 3.46Å
302	Q	94.6	Very high	93.6	Very high	13 Å²	13	34.6 Å²	34.6	6%	0.061	18%	0.176	C	C	.	.	H	α-helix	trans	-67.5	-42.5	174.8	-65	-64.2	-13	0	0	111.7	Y267 C270 R297 Q298 E299 C304 L305 N306	Y267-Q302 HydrophobicContact CE1-CG 4.04Å; Y267-Q302 HydrophobicContact CE2-CG 4.13Å; Y267-Q302 WeakPolarHBondContact OH-CG 3.39Å; Y267-Q302 PolarHBondContact OH-NE2 2.85Å; C270-Q302 HydrophobicContact CB-CB 4.42Å; R297-Q302 VanDerWaalsContact CZ-NE2 3.33Å; Q298-Q302 PolarHBondContact O-N 3.28Å; E299-Q302 PolarHBondContact O-N 3.45Å; Q302-C304 VanDerWaalsContact C-N 3.31Å; Q302-C304 PolarHBondContact O-N 2.99Å; Q302-L305 PolarHBondContact O-N 3.38Å; Q302-N306 WeakPolarHBondContact O-CB 3.39Å; Q302-N306 PolarHBondContact O-N 3.21Å; Q302-N306 VanDerWaalsContact O-N 3.09Å; Q302-N306 PolarHBondContact O-ND2 3.47Å
303	A	94.9	Very high	93.6	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-59.9	-41.3	174.6	0	0	0	0	0	112.1	E299 I300 G307 R308 T311 L312 L315	E299-A303 PolarHBondContact O-N 3.49Å; I300-A303 PolarHBondContact O-N 2.65Å; A303-G307 PolarHBondContact O-N 3Å; A303-R308 PolarHBondContact O-N 3.43Å; A303-T311 HydrophobicContact CB-CG2 4.08Å; A303-L312 HydrophobicContact CB-CB 4.11Å; A303-L312 HydrophobicContact CB-CD1 4.32Å; A303-L315 HydrophobicContact CB-CD1 3.9Å
304	C	95.8	Very high	93.6	Very high	0 Å²	0	36 Å²	36	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-72.1	-31.2	177.3	-72.6	0	0	0	0	114.8	I300 H301 Q302 C336	I300-C304 WeakPolarHBondContact O-CB 3.32Å; I300-C304 PolarHBondContact O-N 2.75Å; I300-C304 VanDerWaalsContact O-N 3.08Å; I300-C304 PolarHBondContact O-SG 3.07Å; H301-C304 PolarHBondContact O-N 3.34Å; Q302-C304 VanDerWaalsContact C-N 3.31Å; Q302-C304 PolarHBondContact O-N 2.99Å; C304-C336 VanDerWaalsContact CB-SG 3.59Å; C304-C336 VanDerWaalsContact SG-SG 3.61Å
305	L	94	Very high	93.7	Very high	34 Å²	34	30.6 Å²	30.6	18%	0.178	15%	0.149	C	C	.	.	H	α-helix	trans	-74.2	-28.7	174.8	-77.7	171.7	0	0	0	112.7	H301 Q302 L335	H301-L305 WeakPolarHBondContact O-CB 3.48Å; H301-L305 VanDerWaalsContact O-CG 3.29Å; H301-L305 WeakPolarHBondContact O-CG 3.27Å; H301-L305 PolarHBondContact O-N 3.45Å; Q302-L305 PolarHBondContact O-N 3.38Å; L305-L335 HydrophobicContact CD1-CD1 4.03Å; L305-L335 HydrophobicContact CD2-CB 4.06Å; L305-L335 HydrophobicContact CD2-CD1 4.16Å; L305-L335 HydrophobicContact CD2-CD2 4.45Å; L305-L335 HydrophobicContact CD2-CG 4.46Å; L305-L335 HydrophobicContact CG-CB 4.27Å; L305-L335 HydrophobicContact CG-CD1 3.86Å
306	N	91.6	Very high	93.8	Very high	64 Å²	64	26.4 Å²	26.4	34%	0.342	13%	0.131	S	C	.	.	T	Hydrogen-bonded Turn	trans	-103.6	12	-175.9	-62.2	-45.9	0	0	0	113.5	S271 Q302 R308	S271-N306 PolarHBondContact O-ND2 3.41Å; Q302-N306 WeakPolarHBondContact O-CB 3.39Å; Q302-N306 PolarHBondContact O-N 3.21Å; Q302-N306 VanDerWaalsContact O-N 3.09Å; Q302-N306 PolarHBondContact O-ND2 3.47Å; N306-R308 HydrophobicContact CB-CG 4.06Å; N306-R308 PolarHBondContact ND2-NH1 3.03Å; N306-R308 VanDerWaalsContact ND2-NH1 3.2Å; N306-R308 WeakPolarHBondContact O-CG 3.46Å; N306-R308 PolarHBondContact O-N 3.32Å
307	G	92.1	Very high	93.8	Very high	18 Å²	18	26.7 Å²	26.7	19%	0.186	13%	0.129	C	C	.	.	T	Hydrogen-bonded Turn	trans	67.2	13.5	176.7	0	0	0	0	0	116.5	A303 S309 E341 C344	A303-G307 PolarHBondContact O-N 3Å; G307-S309 VanDerWaalsContact C-N 3.32Å; G307-S309 PolarHBondContact O-N 3.33Å; G307-E341 WeakPolarHBondContact CA-OE2 3.43Å; G307-C344 VanDerWaalsContact C-SG 3.53Å
308	R	92	Very high	93.6	Very high	29 Å²	29	24.6 Å²	24.6	11%	0.109	12%	0.121	C	C	.	.			trans	-83.4	70.6	-167.9	-57	-160.9	-175.4	99.6	9.1	112.7	C270 S271 E272 D273 A303 N306 K310 T311 L312	C270-R308 PolarHBondContact O-NH1 2.95Å; S271-R308 PolarHBondContact O-NH1 3.29Å; S271-R308 PolarHBondContact O-NH2 2.84Å; E272-R308 VanDerWaalsContact C-CZ 3.43Å; E272-R308 VanDerWaalsContact C-NH2 3.26Å; E272-R308 PolarHBondContact O-NH1 2.88Å; E272-R308 PolarHBondContact O-NH2 3.03Å; D273-R308 VanDerWaalsContact CA-NH2 3.3Å; D273-R308 VanDerWaalsContact N-NH2 3.2Å; D273-R308 IonicContact OD1-CZ 3Å; D273-R308 IonicContact OD1-NE 3.74Å; D273-R308 PolarHBondContact OD1-NE 2.93Å; D273-R308 IonicContact OD1-NH2 2.66Å; D273-R308 PolarHBondContact OD1-NH2 3.34Å; A303-R308 PolarHBondContact O-N 3.43Å; N306-R308 HydrophobicContact CB-CG 4.06Å; N306-R308 PolarHBondContact ND2-NH1 3.03Å; N306-R308 VanDerWaalsContact ND2-NH1 3.2Å; N306-R308 WeakPolarHBondContact O-CG 3.46Å; N306-R308 PolarHBondContact O-N 3.32Å; R308-K310 PolarHBondContact O-N 2.93Å; R308-K310 VanDerWaalsContact O-N 3.16Å; R308-T311 WeakPolarHBondContact O-CB 3.45Å; R308-T311 PolarHBondContact O-N 3.36Å; R308-T311 VanDerWaalsContact O-N 3.07Å; R308-L312 WeakPolarHBondContact O-CB 3.48Å; R308-L312 PolarHBondContact O-N 2.85Å
309	S	93.3	Very high	93.3	Very high	23 Å²	23	25.8 Å²	25.8	16%	0.161	14%	0.142	C	C	.	.	H	α-helix	trans	-52.4	-36.7	-179.3	62.6	0	0	0	0	114	G307 K313 E343	G307-S309 VanDerWaalsContact C-N 3.32Å; G307-S309 PolarHBondContact O-N 3.33Å; S309-K313 WeakPolarHBondContact O-CB 3.19Å; S309-K313 PolarHBondContact O-N 3.42Å; S309-E343 WeakPolarHBondContact CB-OE2 3.16Å; S309-E343 PolarHBondContact OG-OE2 3.44Å
310	K	93.2	Very high	93.2	Very high	153 Å²	153	26.3 Å²	26.3	67%	0.665	15%	0.146	S	C	*	.	H	α-helix	trans	-66.6	-50	174.7	-66	180	-177.7	174.5	0	112.7	P276 R308 L312 K313 Q314	P276-K310 HydrophobicContact CB-CB 4.39Å; R308-K310 PolarHBondContact O-N 2.93Å; R308-K310 VanDerWaalsContact O-N 3.16Å; K310-L312 VanDerWaalsContact C-N 3.35Å; K310-K313 PolarHBondContact O-N 3.45Å; K310-Q314 PolarHBondContact O-N 2.89Å
311	T	93.9	Very high	93	Very high	5 Å²	5	29 Å²	29	3%	0.031	16%	0.161	C	C	.	.	H	α-helix	trans	-58.7	-48.3	175.2	-58.4	0	0	0	0	110.5	C270 I279 A303 R308 K313 Q314 L315	C270-T311 HydrophobicContact CB-CG2 4.38Å; I279-T311 HydrophobicContact CD1-CG2 3.55Å; I279-T311 WeakPolarHBondContact CD1-OG1 3.4Å; I279-T311 HydrophobicContact CG1-CG2 4.17Å; I279-T311 HydrophobicContact CG2-CG2 4.34Å; A303-T311 HydrophobicContact CB-CG2 4.08Å; R308-T311 WeakPolarHBondContact O-CB 3.45Å; R308-T311 PolarHBondContact O-N 3.36Å; R308-T311 VanDerWaalsContact O-N 3.07Å; T311-K313 VanDerWaalsContact C-N 3.33Å; T311-K313 PolarHBondContact O-N 3.08Å; T311-Q314 WeakPolarHBondContact O-CB 3.34Å; T311-Q314 PolarHBondContact O-N 2.9Å; T311-Q314 VanDerWaalsContact O-N 3.08Å; T311-L315 HydrophobicContact CG2-CD1 4.23Å; T311-L315 HydrophobicContact CG2-CG 4.47Å; T311-L315 WeakPolarHBondContact O-CG 3.37Å; T311-L315 PolarHBondContact O-N 2.84Å
312	L	94.9	Very high	92.9	Very high	0 Å²	0	30 Å²	30	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-55.9	-46.3	177.8	-177.6	62.3	0	0	0	111.4	I300 A303 R308 K310 Q314 L315 I316 C344 L347 L348	I300-L312 HydrophobicContact CD1-CD1 4.17Å; I300-L312 HydrophobicContact CG1-CD1 3.54Å; A303-L312 HydrophobicContact CB-CB 4.11Å; A303-L312 HydrophobicContact CB-CD1 4.32Å; R308-L312 WeakPolarHBondContact O-CB 3.48Å; R308-L312 PolarHBondContact O-N 2.85Å; K310-L312 VanDerWaalsContact C-N 3.35Å; L312-Q314 VanDerWaalsContact C-N 3.3Å; L312-Q314 PolarHBondContact O-N 3.06Å; L312-L315 PolarHBondContact O-N 2.99Å; L312-L315 VanDerWaalsContact O-N 3.17Å; L312-I316 HydrophobicContact CD1-CD1 4.32Å; L312-I316 HydrophobicContact CD1-CG1 4.47Å; L312-I316 HydrophobicContact CG-CD1 4.12Å; L312-I316 VanDerWaalsContact O-CG1 3.3Å; L312-I316 WeakPolarHBondContact O-CG1 3.35Å; L312-I316 PolarHBondContact O-N 2.81Å; L312-C344 HydrophobicContact CD2-CB 3.63Å; L312-L347 HydrophobicContact CB-CD2 4.08Å; L312-L347 HydrophobicContact CD2-CB 4.46Å; L312-L347 HydrophobicContact CD2-CD2 3.81Å; L312-L347 HydrophobicContact CG-CD2 3.73Å; L312-L348 HydrophobicContact CD1-CD2 4.38Å; L312-L348 HydrophobicContact CD2-CG 4.24Å
313	K	93.5	Very high	93	Very high	73 Å²	73	31.6 Å²	31.6	32%	0.317	18%	0.175	S	C	.	.	H	α-helix	trans	-59.3	-38.8	176.6	-170.2	172.8	-178.4	171.8	0	112.7	S309 K310 T311 I317 L347 Y351	S309-K313 WeakPolarHBondContact O-CB 3.19Å; S309-K313 PolarHBondContact O-N 3.42Å; K310-K313 PolarHBondContact O-N 3.45Å; T311-K313 VanDerWaalsContact C-N 3.33Å; T311-K313 PolarHBondContact O-N 3.08Å; K313-I317 HydrophobicContact CG-CD1 4.04Å; K313-I317 WeakPolarHBondContact O-CD1 3.5Å; K313-I317 VanDerWaalsContact O-CG1 3.29Å; K313-I317 WeakPolarHBondContact O-CG1 3.46Å; K313-I317 PolarHBondContact O-N 3.46Å; K313-L347 HydrophobicContact CB-CD1 4.38Å; K313-L347 HydrophobicContact CB-CD2 3.84Å; K313-L347 HydrophobicContact CD-CD1 4.37Å; K313-L347 HydrophobicContact CG-CD1 4.45Å; K313-Y351 WeakPolarHBondContact CE-OH 3.19Å
314	Q	92.6	Very high	92.9	Very high	25 Å²	25	31.8 Å²	31.8	12%	0.117	18%	0.177	C	C	.	.	H	α-helix	trans	-65.5	-46.3	174.6	-66.5	169.4	-28.4	0	0	111.4	P276 I279 L283 K310 T311 L312 I316 I317 Y318	P276-Q314 PolarHBondContact O-NE2 2.85Å; P276-Q314 PolarHBondContact O-OE1 2.84Å; P276-Q314 VanDerWaalsContact O-OE1 3.1Å; I279-Q314 HydrophobicContact CG2-CB 4.34Å; L283-Q314 HydrophobicContact CD1-CB 4.12Å; K310-Q314 PolarHBondContact O-N 2.89Å; T311-Q314 WeakPolarHBondContact O-CB 3.34Å; T311-Q314 PolarHBondContact O-N 2.9Å; T311-Q314 VanDerWaalsContact O-N 3.08Å; L312-Q314 VanDerWaalsContact C-N 3.3Å; L312-Q314 PolarHBondContact O-N 3.06Å; Q314-I316 VanDerWaalsContact C-N 3.3Å; Q314-I316 PolarHBondContact O-N 3.23Å; Q314-I317 PolarHBondContact O-N 2.84Å; Q314-Y318 WeakPolarHBondContact O-CD2 3.47Å; Q314-Y318 PolarHBondContact O-N 2.91Å; Q314-Y318 VanDerWaalsContact O-N 3.14Å
315	L	93.6	Very high	92.8	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-58.5	-41.2	177.3	-62.8	173.3	0	0	0	111.9	L283 L289 E299 A303 T311 L312 Y318 G319 A320	L283-L315 HydrophobicContact CD1-CD2 4.36Å; L289-L315 HydrophobicContact CD2-CD2 3.5Å; L289-L315 VanDerWaalsContact CD2-CD2 3.5Å; E299-L315 HydrophobicContact CB-CD1 4.17Å; E299-L315 HydrophobicContact CB-CD2 4.26Å; A303-L315 HydrophobicContact CB-CD1 3.9Å; T311-L315 HydrophobicContact CG2-CD1 4.23Å; T311-L315 HydrophobicContact CG2-CG 4.47Å; T311-L315 WeakPolarHBondContact O-CG 3.37Å; T311-L315 PolarHBondContact O-N 2.84Å; L312-L315 PolarHBondContact O-N 2.99Å; L312-L315 VanDerWaalsContact O-N 3.17Å; L315-Y318 PolarHBondContact O-N 3.18Å; L315-G319 PolarHBondContact O-N 2.84Å; L315-A320 HydrophobicContact CB-CB 4.01Å; L315-A320 VanDerWaalsContact O-CB 3.26Å; L315-A320 WeakPolarHBondContact O-CB 3.42Å; L315-A320 PolarHBondContact O-N 2.92Å
316	I	93	Very high	92.8	Very high	3 Å²	3	34.4 Å²	34.4	2%	0.015	19%	0.189	C	C	.	.	H	α-helix	trans	-64.3	-45.7	176.5	-64.3	177.3	0	0	0	111.4	L312 Q314 Y318 G319 L322 L347 L348 Y351 I392	L312-I316 HydrophobicContact CD1-CD1 4.32Å; L312-I316 HydrophobicContact CD1-CG1 4.47Å; L312-I316 HydrophobicContact CG-CD1 4.12Å; L312-I316 VanDerWaalsContact O-CG1 3.3Å; L312-I316 WeakPolarHBondContact O-CG1 3.35Å; L312-I316 PolarHBondContact O-N 2.81Å; Q314-I316 VanDerWaalsContact C-N 3.3Å; Q314-I316 PolarHBondContact O-N 3.23Å; I316-Y318 PolarHBondContact O-N 3.15Å; I316-G319 PolarHBondContact O-N 2.9Å; I316-L322 HydrophobicContact CB-CD2 4.43Å; I316-L322 HydrophobicContact CD1-CD2 3.72Å; I316-L322 HydrophobicContact CG1-CD2 3.57Å; I316-L322 HydrophobicContact CG2-CD2 4.18Å; I316-L347 HydrophobicContact CD1-CD2 3.92Å; I316-L347 HydrophobicContact CD1-CG 4.48Å; I316-L348 HydrophobicContact CD1-CD2 4.39Å; I316-Y351 HydrophobicContact CD1-CD2 3.85Å; I316-Y351 HydrophobicContact CG2-CD2 3.8Å; I316-Y351 HydrophobicContact CG2-CE2 4.4Å; I316-Y351 HydrophobicContact CG2-CG 3.87Å; I316-I392 HydrophobicContact CG2-CD1 3.86Å; I316-I392 HydrophobicContact CG2-CG1 4.43Å
317	I	91.7	Very high	92.8	Very high	20 Å²	20	37.6 Å²	37.6	10%	0.103	20%	0.202	C	C	.	.	H	α-helix	trans	-58.5	-34.4	178	-75.1	164	0	0	0	112.3	K313 Q314 G319 I392 Q394 P396	K313-I317 HydrophobicContact CG-CD1 4.04Å; K313-I317 WeakPolarHBondContact O-CD1 3.5Å; K313-I317 VanDerWaalsContact O-CG1 3.29Å; K313-I317 WeakPolarHBondContact O-CG1 3.46Å; K313-I317 PolarHBondContact O-N 3.46Å; Q314-I317 PolarHBondContact O-N 2.84Å; I317-G319 VanDerWaalsContact C-N 3.35Å; I317-I392 HydrophobicContact CG1-CG2 4.19Å; I317-Q394 HydrophobicContact CD1-CB 4.21Å; I317-Q394 HydrophobicContact CG1-CB 4.39Å; I317-P396 HydrophobicContact CG2-CB 4.42Å; I317-P396 WeakPolarHBondContact O-CD 3.47Å
318	Y	90	Very high	92.8	Very high	20 Å²	20	41.7 Å²	41.7	8%	0.078	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.3	3.8	176.9	-76.2	-101.2	0	0	0	114.2	L283 L289 Q314 L315 I316 P396 V397 Y398	L283-Y318 HydrophobicContact CB-CD1 3.8Å; L283-Y318 HydrophobicContact CB-CD2 3.97Å; L283-Y318 HydrophobicContact CB-CE1 3.71Å; L283-Y318 HydrophobicContact CB-CE2 3.87Å; L283-Y318 HydrophobicContact CB-CG 3.91Å; L283-Y318 HydrophobicContact CD1-CD2 3.77Å; L283-Y318 HydrophobicContact CD1-CE2 4.14Å; L283-Y318 HydrophobicContact CD1-CG 4.1Å; L283-Y318 HydrophobicContact CD2-CG 4.24Å; L283-Y318 HydrophobicContact CG-CD2 4.37Å; L283-Y318 HydrophobicContact CG-CG 4.32Å; L283-Y318 WeakPolarHBondContact O-CE1 3.46Å; L289-Y318 WeakPolarHBondContact CD1-O 3.42Å; Q314-Y318 WeakPolarHBondContact O-CD2 3.47Å; Q314-Y318 PolarHBondContact O-N 2.91Å; Q314-Y318 VanDerWaalsContact O-N 3.14Å; L315-Y318 PolarHBondContact O-N 3.18Å; I316-Y318 PolarHBondContact O-N 3.15Å; Y318-P396 HydrophobicContact CD1-CB 3.71Å; Y318-P396 HydrophobicContact CD2-CB 4.33Å; Y318-P396 HydrophobicContact CE1-CB 3.96Å; Y318-P396 HydrophobicContact CG-CB 3.94Å; Y318-V397 PolarHBondContact OH-O 2.64Å; Y318-Y398 HydrophobicContact CD1-CD1 4.37Å; Y318-Y398 AromaticContact CD1-CE1 3.55Å; Y318-Y398 HydrophobicContact CD1-CE1 3.55Å; Y318-Y398 AromaticContact CD1-CZ 3.76Å; Y318-Y398 HydrophobicContact CE1-CD1 4.06Å; Y318-Y398 AromaticContact CE1-CE1 3.7Å; Y318-Y398 HydrophobicContact CE1-CE1 3.7Å
319	G	89.3	Confident	92.9	Very high	59 Å²	59	43.6 Å²	43.6	61%	0.608	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	94.8	29.2	169.3	0	0	0	0	0	116.1	L315 I316 I317	L315-G319 PolarHBondContact O-N 2.84Å; I316-G319 PolarHBondContact O-N 2.9Å; I317-G319 VanDerWaalsContact C-N 3.35Å
320	A	92.4	Very high	93	Very high	12 Å²	12	43.4 Å²	43.4	10%	0.099	23%	0.227	C	C	.	.			trans	-62.9	142.2	172.4	0	0	0	0	0	112.4	L289 I300 L315 L322	L289-A320 HydrophobicContact CD1-CB 4.23Å; L289-A320 HydrophobicContact CD2-CB 4.48Å; I300-A320 HydrophobicContact CB-CB 4.4Å; I300-A320 HydrophobicContact CD1-CB 4.17Å; L315-A320 HydrophobicContact CB-CB 4.01Å; L315-A320 VanDerWaalsContact O-CB 3.26Å; L315-A320 WeakPolarHBondContact O-CB 3.42Å; L315-A320 PolarHBondContact O-N 2.92Å; A320-L322 PolarHBondContact O-N 2.82Å; A320-L322 VanDerWaalsContact O-N 3.16Å
321	D	91.4	Very high	93.2	Very high	59 Å²	59	36.1 Å²	36.1	32%	0.316	20%	0.195	S	C	.	.			trans	-74.5	106.1	-179.7	-175.5	-2.2	0	0	0	111.3	N323 A324 Q565	D321-N323 PolarHBondContact O-N 3.03Å; D321-N323 VanDerWaalsContact O-N 3.13Å; D321-N323 WeakPolarHBondContact OD1-CA 3.48Å; D321-N323 PolarHBondContact OD1-N 2.85Å; D321-A324 HydrophobicContact CB-CB 4.15Å; D321-A324 WeakPolarHBondContact O-CB 3.38Å; D321-A324 PolarHBondContact O-N 2.83Å; D321-A324 PolarHBondContact OD1-N 3.35Å; D321-Q565 PolarHBondContact OD2-NE2 2.93Å; D321-Q565 VanDerWaalsContact OD2-NE2 3.15Å
322	L	94.2	Very high	93.3	Very high	21 Å²	21	35.9 Å²	35.9	11%	0.11	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.4	-22.3	177.7	-52.5	-175	0	0	0	113.8	I300 I316 A320 P332 L348 Y351 A353	I300-L322 HydrophobicContact CD1-CD2 4.11Å; I316-L322 HydrophobicContact CB-CD2 4.43Å; I316-L322 HydrophobicContact CD1-CD2 3.72Å; I316-L322 HydrophobicContact CG1-CD2 3.57Å; I316-L322 HydrophobicContact CG2-CD2 4.18Å; A320-L322 PolarHBondContact O-N 2.82Å; A320-L322 VanDerWaalsContact O-N 3.16Å; L322-P332 WeakPolarHBondContact O-CD 3.36Å; L322-L348 HydrophobicContact CD2-CD2 4.11Å; L322-Y351 WeakPolarHBondContact CD1-O 3.25Å; L322-A353 HydrophobicContact CB-CB 3.92Å; L322-A353 HydrophobicContact CD1-CB 4.4Å
323	N	94.9	Very high	93.4	Very high	45 Å²	45	35.9 Å²	35.9	24%	0.241	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	-114.4	9.2	-171.3	-60.9	-63	0	0	0	112.7	D321 L354 I357	D321-N323 PolarHBondContact O-N 3.03Å; D321-N323 VanDerWaalsContact O-N 3.13Å; D321-N323 WeakPolarHBondContact OD1-CA 3.48Å; D321-N323 PolarHBondContact OD1-N 2.85Å; N323-L354 WeakPolarHBondContact OD1-CB 3.16Å; N323-L354 WeakPolarHBondContact OD1-CG 3.42Å; N323-L354 PolarHBondContact OD1-N 2.86Å; N323-I357 HydrophobicContact CB-CD1 3.77Å
324	A	93.9	Very high	93.6	Very high	4 Å²	4	32.4 Å²	32.4	3%	0.033	18%	0.179	C	C	.	.			trans	-52.8	153.2	172.9	0	0	0	0	0	111.4	Q298 H301 D321 T331 P332	Q298-A324 VanDerWaalsContact OE1-CB 3.32Å; H301-A324 PolarHBondContact NE2-O 2.77Å; D321-A324 HydrophobicContact CB-CB 4.15Å; D321-A324 WeakPolarHBondContact O-CB 3.38Å; D321-A324 PolarHBondContact O-N 2.83Å; D321-A324 PolarHBondContact OD1-N 3.35Å; A324-T331 WeakPolarHBondContact O-CA 3.45Å; A324-P332 WeakPolarHBondContact O-CD 3.33Å
325	Q	94.5	Very high	93.7	Very high	74 Å²	74	31.8 Å²	31.8	35%	0.346	18%	0.176	S	C	.	.			trans	-125.6	135.6	-178.1	-76.5	-171.5	-36.4	0	0	111.3	H329 T331 I357 I358	Q325-H329 PolarHBondContact NE2-O 3.06Å; Q325-H329 PolarHBondContact OE1-ND1 3.28Å; Q325-T331 HydrophobicContact CG-CG2 3.91Å; Q325-I357 VanDerWaalsContact NE2-CG2 3.35Å; Q325-I358 PolarHBondContact NE2-O 3.22Å
326	V	94	Very high	93.9	Very high	15 Å²	15	31.8 Å²	31.8	9%	0.091	18%	0.176	C	C	.	.			trans	-76.9	174.2	166.3	-45.5	0	0	0	0	110.3	R297 H301 N328 H329 N330 L335	R297-V326 HydrophobicContact CB-CG1 4.44Å; R297-V326 HydrophobicContact CG-CB 4.37Å; R297-V326 HydrophobicContact CG-CG1 3.85Å; H301-V326 VanDerWaalsContact CD2-CG1 3.44Å; H301-V326 WeakPolarHBondContact CD2-CG1 3.15Å; V326-N328 HydrophobicContact CG2-CB 4.3Å; V326-N328 PolarHBondContact O-N 2.99Å; V326-N328 VanDerWaalsContact O-N 3.11Å; V326-H329 WeakPolarHBondContact O-CA 3.13Å; V326-H329 PolarHBondContact O-N 3.25Å; V326-N330 HydrophobicContact CG2-CB 3.82Å; V326-N330 PolarHBondContact N-O 3.03Å; V326-N330 VanDerWaalsContact N-O 3.12Å; V326-L335 HydrophobicContact CG1-CD1 4.32Å
327	E	91.5	Very high	94	Very high	131 Å²	131	31.6 Å²	31.6	61%	0.612	18%	0.175	S	C	*	.	T	Hydrogen-bonded Turn	trans	-53	-35.8	-179.7	-71	-179.6	146	0	0	114.3	K295 H329	K295-E327 WeakPolarHBondContact CA-OE2 3.36Å; K295-E327 PolarHBondContact O-N 2.88Å; E327-H329 PolarHBondContact O-N 3.38Å
328	N	91.6	Very high	94.2	Very high	105 Å²	105	33.3 Å²	33.3	56%	0.561	18%	0.184	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.1	18	176.1	-69	-10.7	0	0	0	113.8	V326 N330 S360	V326-N328 HydrophobicContact CG2-CB 4.3Å; V326-N328 PolarHBondContact O-N 2.99Å; V326-N328 VanDerWaalsContact O-N 3.11Å; N328-N330 PolarHBondContact O-N 3.33Å; N328-S360 WeakPolarHBondContact CA-OG 3.37Å; N328-S360 PolarHBondContact O-N 3.22Å; N328-S360 PolarHBondContact O-OG 3.2Å; N328-S360 VanDerWaalsContact O-OG 3.13Å
329	H	93.9	Very high	94.4	Very high	69 Å²	69	32.9 Å²	32.9	32%	0.319	19%	0.185	S	C	.	.			trans	53.5	7.4	-174.9	-69.2	-58.9	0	0	0	116.2	Q325 V326 E327 T331 S360	Q325-H329 PolarHBondContact NE2-O 3.06Å; Q325-H329 PolarHBondContact OE1-ND1 3.28Å; V326-H329 WeakPolarHBondContact O-CA 3.13Å; V326-H329 PolarHBondContact O-N 3.25Å; E327-H329 PolarHBondContact O-N 3.38Å; H329-T331 PolarHBondContact O-N 3.1Å; H329-S360 PolarHBondContact CD2-OG 3.3Å; H329-S360 VanDerWaalsContact CD2-OG 3.29Å
330	N	96	Very high	94.7	Very high	18 Å²	18	32.6 Å²	32.6	10%	0.096	17%	0.169	C	C	.	.			trans	-64.2	130.6	170.7	-73.8	-42.9	0	0	0	110	V326 N328 H334 L335 N359	V326-N330 HydrophobicContact CG2-CB 3.82Å; V326-N330 PolarHBondContact N-O 3.03Å; V326-N330 VanDerWaalsContact N-O 3.12Å; N328-N330 PolarHBondContact O-N 3.33Å; N330-H334 HydrophobicContact CB-CB 3.76Å; N330-H334 WeakPolarHBondContact OD1-CB 3.45Å; N330-L335 HydrophobicContact CB-CD2 3.9Å; N330-N359 WeakPolarHBondContact OD1-CB 3.34Å; N330-N359 PolarHBondContact OD1-ND2 2.83Å
331	T	96.7	Very high	94.8	Very high	1 Å²	1	34.6 Å²	34.6	1%	0.006	18%	0.177	C	C	.	.			trans	-89.7	171	171.6	64.8	0	0	0	0	111.6	A324 Q325 H329 L333 H334 L335 I357	A324-T331 WeakPolarHBondContact O-CA 3.45Å; Q325-T331 HydrophobicContact CG-CG2 3.91Å; H329-T331 PolarHBondContact O-N 3.1Å; T331-L333 PolarHBondContact O-N 3.46Å; T331-L333 VanDerWaalsContact O-N 3.16Å; T331-H334 PolarHBondContact N-ND1 2.89Å; T331-H334 VanDerWaalsContact N-ND1 3.15Å; T331-H334 WeakPolarHBondContact O-CB 3.2Å; T331-H334 PolarHBondContact O-N 3.43Å; T331-H334 PolarHBondContact OG1-ND1 3.15Å; T331-L335 PolarHBondContact O-N 2.96Å; T331-I357 HydrophobicContact CG2-CB 4Å; T331-I357 HydrophobicContact CG2-CD1 3.96Å; T331-I357 HydrophobicContact CG2-CG2 3.57Å
332	P	96.5	Very high	95	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-50.9	-37	173.3	-31.2	38.3	0	0	0	114	I300 H301 L322 A324 L335 C336 L348	I300-P332 HydrophobicContact CD1-CG 4.11Å; I300-P332 HydrophobicContact CG1-CB 4.36Å; I300-P332 HydrophobicContact CG1-CG 4.08Å; I300-P332 HydrophobicContact CG2-CG 4.03Å; H301-P332 WeakPolarHBondContact NE2-CD 3.23Å; L322-P332 WeakPolarHBondContact O-CD 3.36Å; A324-P332 WeakPolarHBondContact O-CD 3.33Å; P332-L335 PolarHBondContact O-N 3.43Å; P332-C336 PolarHBondContact O-N 3.05Å; P332-C336 PolarHBondContact O-SG 3.47Å; P332-C336 VanDerWaalsContact O-SG 3.33Å; P332-L348 HydrophobicContact CB-CD1 3.62Å; P332-L348 HydrophobicContact CB-CD2 4.03Å
333	L	96.7	Very high	95.1	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-62.1	-43.6	174.2	-74.5	174.4	0	0	0	112.7	T331 L335 C336 V337 L345 L348 L349 A353 P355 P365	T331-L333 PolarHBondContact O-N 3.46Å; T331-L333 VanDerWaalsContact O-N 3.16Å; L333-L335 VanDerWaalsContact C-N 3.27Å; L333-L335 PolarHBondContact O-N 2.88Å; L333-C336 PolarHBondContact O-N 3.5Å; L333-V337 WeakPolarHBondContact O-CG2 3.45Å; L333-V337 PolarHBondContact O-N 3.22Å; L333-L345 HydrophobicContact CD2-CG 4.22Å; L333-L348 HydrophobicContact CD2-CB 3.61Å; L333-L348 HydrophobicContact CD2-CD1 3.82Å; L333-L348 HydrophobicContact CD2-CG 4.4Å; L333-L348 HydrophobicContact CG-CB 4.26Å; L333-L348 HydrophobicContact CG-CD1 4.08Å; L333-L349 HydrophobicContact CD1-CD2 4.04Å; L333-L349 HydrophobicContact CD2-CD2 4.01Å; L333-L349 HydrophobicContact CD2-CG 3.98Å; L333-A353 HydrophobicContact CD1-CB 3.77Å; L333-A353 HydrophobicContact CD2-CB 4.37Å; L333-A353 HydrophobicContact CG-CB 3.94Å; L333-P355 HydrophobicContact CD1-CB 4.37Å; L333-P365 HydrophobicContact CB-CB 4.19Å; L333-P365 HydrophobicContact CB-CG 3.81Å
334	H	96.8	Very high	95.1	Very high	0 Å²	0	39 Å²	39	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-62	-37.7	174.2	-65.9	87.1	0	0	0	111.2	N330 T331 V337 L338 I357 Q363 P365 L368	N330-H334 HydrophobicContact CB-CB 3.76Å; N330-H334 WeakPolarHBondContact OD1-CB 3.45Å; T331-H334 PolarHBondContact N-ND1 2.89Å; T331-H334 VanDerWaalsContact N-ND1 3.15Å; T331-H334 WeakPolarHBondContact O-CB 3.2Å; T331-H334 PolarHBondContact O-N 3.43Å; T331-H334 PolarHBondContact OG1-ND1 3.15Å; H334-V337 CarbonylContact O-C 3.58Å; H334-V337 WeakPolarHBondContact O-CB 3.29Å; H334-V337 PolarHBondContact O-N 3.28Å; H334-L338 WeakPolarHBondContact O-CG 3.4Å; H334-L338 PolarHBondContact O-N 3.1Å; H334-I357 PolarHBondContact CE1-O 2.91Å; H334-Q363 PolarHBondContact NE2-O 3.21Å; H334-P365 WeakPolarHBondContact NE2-CD 3.44Å; H334-L368 HydrophobicContact CB-CD2 4.16Å
335	L	95.6	Very high	95.3	Very high	11 Å²	11	38.8 Å²	38.8	6%	0.058	19%	0.193	C	C	.	.	H	α-helix	trans	-71	-37.1	178.9	-60.2	-163.3	0	0	0	112.4	H301 L305 V326 N330 T331 P332 L333 V337 L338 A339	H301-L335 HydrophobicContact CB-CD1 3.62Å; H301-L335 VanDerWaalsContact CD2-CD1 3.49Å; H301-L335 WeakPolarHBondContact CD2-CD1 3.46Å; L305-L335 HydrophobicContact CD1-CD1 4.03Å; L305-L335 HydrophobicContact CD2-CB 4.06Å; L305-L335 HydrophobicContact CD2-CD1 4.16Å; L305-L335 HydrophobicContact CD2-CD2 4.45Å; L305-L335 HydrophobicContact CD2-CG 4.46Å; L305-L335 HydrophobicContact CG-CB 4.27Å; L305-L335 HydrophobicContact CG-CD1 3.86Å; V326-L335 HydrophobicContact CG1-CD1 4.32Å; N330-L335 HydrophobicContact CB-CD2 3.9Å; T331-L335 PolarHBondContact O-N 2.96Å; P332-L335 PolarHBondContact O-N 3.43Å; L333-L335 VanDerWaalsContact C-N 3.27Å; L333-L335 PolarHBondContact O-N 2.88Å; L335-V337 VanDerWaalsContact C-N 3.29Å; L335-V337 PolarHBondContact O-N 3.29Å; L335-L338 HydrophobicContact CD2-CD1 3.94Å; L335-L338 CarbonylContact O-C 3.57Å; L335-L338 PolarHBondContact O-N 3.13Å; L335-A339 WeakPolarHBondContact O-CB 3.31Å; L335-A339 PolarHBondContact O-N 3.11Å
336	C	96.7	Very high	95.3	Very high	0 Å²	0	39 Å²	39	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-60.8	-40.4	168.9	-62.6	0	0	0	0	111.4	C304 P332 L333 L338 A339 D340 E341 C344 L345	C304-C336 VanDerWaalsContact CB-SG 3.59Å; C304-C336 VanDerWaalsContact SG-SG 3.61Å; P332-C336 PolarHBondContact O-N 3.05Å; P332-C336 PolarHBondContact O-SG 3.47Å; P332-C336 VanDerWaalsContact O-SG 3.33Å; L333-C336 PolarHBondContact O-N 3.5Å; C336-L338 PolarHBondContact O-N 2.84Å; C336-A339 PolarHBondContact O-N 3.12Å; C336-D340 WeakPolarHBondContact O-CA 3.5Å; C336-D340 PolarHBondContact O-N 3.42Å; C336-E341 HydrophobicContact CB-CB 4.37Å; C336-E341 PolarHBondContact O-N 3.46Å; C336-C344 WeakPolarHBondContact SG-CB 3.44Å; C336-L345 HydrophobicContact CB-CB 3.86Å; C336-L345 HydrophobicContact CB-CD1 4.35Å
337	V	96.4	Very high	95.3	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-65.3	-20.6	173.3	170.5	0	0	0	0	113.1	L333 H334 L335 L345 P365 L368 A369 R374 L377 L381	L333-V337 WeakPolarHBondContact O-CG2 3.45Å; L333-V337 PolarHBondContact O-N 3.22Å; H334-V337 CarbonylContact O-C 3.58Å; H334-V337 WeakPolarHBondContact O-CB 3.29Å; H334-V337 PolarHBondContact O-N 3.28Å; L335-V337 VanDerWaalsContact C-N 3.29Å; L335-V337 PolarHBondContact O-N 3.29Å; V337-L345 HydrophobicContact CG2-CD1 3.66Å; V337-P365 HydrophobicContact CG2-CB 4.16Å; V337-L368 HydrophobicContact CG1-CB 4.06Å; V337-L368 HydrophobicContact CG1-CD2 4.08Å; V337-L368 HydrophobicContact CG1-CG 3.87Å; V337-A369 HydrophobicContact CG1-CB 3.72Å; V337-A369 HydrophobicContact CG2-CB 4.28Å; V337-R374 WeakPolarHBondContact O-CD 3.44Å; V337-R374 PolarHBondContact O-NH1 3.27Å; V337-L377 HydrophobicContact CG2-CD1 4.48Å; V337-L381 HydrophobicContact CG2-CD1 3.81Å
338	L	95.1	Very high	95.5	Very high	56 Å²	56	33.2 Å²	33.2	29%	0.293	17%	0.169	S	C	.	.	H	α-helix	trans	-93.1	-33.4	174.8	-73.2	161	0	0	0	113.7	H334 L335 C336 L368 I372 R374	H334-L338 WeakPolarHBondContact O-CG 3.4Å; H334-L338 PolarHBondContact O-N 3.1Å; L335-L338 HydrophobicContact CD2-CD1 3.94Å; L335-L338 CarbonylContact O-C 3.57Å; L335-L338 PolarHBondContact O-N 3.13Å; C336-L338 PolarHBondContact O-N 2.84Å; L338-L368 HydrophobicContact CD1-CD2 4.2Å; L338-L368 HydrophobicContact CD2-CD2 4.35Å; L338-L368 HydrophobicContact CG-CD2 4.02Å; L338-I372 HydrophobicContact CD2-CD1 3.57Å; L338-R374 VanDerWaalsContact O-CZ 3.3Å; L338-R374 PolarHBondContact O-NH1 3.1Å; L338-R374 PolarHBondContact O-NH2 2.84Å
339	A	94.3	Very high	95.6	Very high	11 Å²	11	28.5 Å²	28.5	9%	0.091	14%	0.143	C	C	.	.	H	α-helix	trans	-83.2	-26.1	177.8	0	0	0	0	0	113.8	L335 C336 E341	L335-A339 WeakPolarHBondContact O-CB 3.31Å; L335-A339 PolarHBondContact O-N 3.11Å; C336-A339 PolarHBondContact O-N 3.12Å; A339-E341 HydrophobicContact CB-CB 4.49Å; A339-E341 HydrophobicContact CB-CG 3.59Å
340	D	95.2	Very high	95.6	Very high	53 Å²	53	30.5 Å²	30.5	28%	0.283	15%	0.148	S	C	.	.	T	Hydrogen-bonded Turn	trans	91.4	24.7	-179.6	-148.5	30	0	0	0	113.1	C336 M342 R374 R708	C336-D340 WeakPolarHBondContact O-CA 3.5Å; C336-D340 PolarHBondContact O-N 3.42Å; D340-M342 PolarHBondContact O-N 3.03Å; D340-R374 WeakPolarHBondContact OD1-CD 3.47Å; D340-R374 IonicContact OD1-CZ 3.15Å; D340-R374 IonicContact OD1-NE 2.76Å; D340-R374 IonicContact OD1-NH1 3.44Å; D340-R708 VanDerWaalsContact CB-NH2 3.27Å; D340-R708 IonicContact OD2-CZ 3.39Å; D340-R708 VanDerWaalsContact OD2-CZ 3.3Å; D340-R708 IonicContact OD2-NH1 3.22Å; D340-R708 PolarHBondContact OD2-NH1 3.49Å; D340-R708 IonicContact OD2-NH2 2.73Å; D340-R708 PolarHBondContact OD2-NH2 2.8Å
341	E	95.6	Very high	95.3	Very high	54 Å²	54	31 Å²	31	25%	0.252	15%	0.149	S	C	.	.			trans	-93.2	81.2	-162.6	-65	-57.7	150.5	0	0	112.6	G307 C336 A339 E343 C344 L345	G307-E341 WeakPolarHBondContact CA-OE2 3.43Å; C336-E341 HydrophobicContact CB-CB 4.37Å; C336-E341 PolarHBondContact O-N 3.46Å; A339-E341 HydrophobicContact CB-CB 4.49Å; A339-E341 HydrophobicContact CB-CG 3.59Å; E341-E343 PolarHBondContact O-N 2.89Å; E341-C344 HydrophobicContact CB-CB 4.03Å; E341-C344 PolarHBondContact O-N 3.18Å; E341-L345 WeakPolarHBondContact O-CB 3.37Å; E341-L345 PolarHBondContact O-N 2.64Å
342	M	95.3	Very high	95.1	Very high	95 Å²	95	31.9 Å²	31.9	47%	0.468	16%	0.157	S	C	.	.	H	α-helix	trans	-57.3	-42.4	-177.7	-170.8	179.3	70.9	0	0	113.4	D340 L345 L346 L377 I380	D340-M342 PolarHBondContact O-N 3.03Å; M342-L345 PolarHBondContact O-N 2.7Å; M342-L346 HydrophobicContact CG-CD1 3.98Å; M342-L346 WeakPolarHBondContact O-CB 3.35Å; M342-L346 WeakPolarHBondContact O-CG 3.44Å; M342-L346 PolarHBondContact O-N 2.96Å; M342-L377 HydrophobicContact CB-CD2 3.8Å; M342-L377 HydrophobicContact CG-CD2 3.98Å; M342-I380 HydrophobicContact CG-CD1 3.68Å; M342-I380 HydrophobicContact SD-CD1 3.97Å
343	E	95.4	Very high	95	Very high	121 Å²	121	31.9 Å²	31.9	57%	0.565	16%	0.158	S	C	*	.	H	α-helix	trans	-63.6	-45.1	178.2	-69.2	-167.4	-175.5	0	0	111.9	S309 E341 L346 L347	S309-E343 WeakPolarHBondContact CB-OE2 3.16Å; S309-E343 PolarHBondContact OG-OE2 3.44Å; E341-E343 PolarHBondContact O-N 2.89Å; E343-L346 PolarHBondContact O-N 2.88Å; E343-L347 VanDerWaalsContact O-CB 3.32Å; E343-L347 WeakPolarHBondContact O-CB 3.29Å; E343-L347 PolarHBondContact O-N 3.19Å
344	C	96.3	Very high	94.8	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-66.2	-39.8	179.8	-67.8	0	0	0	0	111.3	G307 L312 C336 E341 L347 L348	G307-C344 VanDerWaalsContact C-SG 3.53Å; L312-C344 HydrophobicContact CD2-CB 3.63Å; C336-C344 WeakPolarHBondContact SG-CB 3.44Å; E341-C344 HydrophobicContact CB-CB 4.03Å; E341-C344 PolarHBondContact O-N 3.18Å; C344-L347 PolarHBondContact O-N 3.18Å; C344-L348 WeakPolarHBondContact O-CB 3.44Å; C344-L348 VanDerWaalsContact O-CG 3.3Å; C344-L348 WeakPolarHBondContact O-CG 3.45Å; C344-L348 PolarHBondContact O-N 3.21Å
345	L	96.6	Very high	94.7	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-62.4	-47.7	175.1	-175.9	142.3	0	0	0	112	L333 C336 V337 E341 M342 L347 L348 L349 L377 I380 L381	L333-L345 HydrophobicContact CD2-CG 4.22Å; C336-L345 HydrophobicContact CB-CB 3.86Å; C336-L345 HydrophobicContact CB-CD1 4.35Å; V337-L345 HydrophobicContact CG2-CD1 3.66Å; E341-L345 WeakPolarHBondContact O-CB 3.37Å; E341-L345 PolarHBondContact O-N 2.64Å; M342-L345 PolarHBondContact O-N 2.7Å; L345-L347 VanDerWaalsContact C-N 3.33Å; L345-L347 PolarHBondContact O-N 2.97Å; L345-L348 PolarHBondContact O-N 3.25Å; L345-L349 HydrophobicContact CD2-CD1 3.67Å; L345-L349 HydrophobicContact CG-CD1 4.4Å; L345-L349 WeakPolarHBondContact O-CG 3.26Å; L345-L349 PolarHBondContact O-N 2.96Å; L345-L377 HydrophobicContact CD1-CB 4.23Å; L345-L377 HydrophobicContact CD1-CD1 4.42Å; L345-L377 HydrophobicContact CD1-CD2 4.36Å; L345-I380 HydrophobicContact CD2-CB 4.11Å; L345-I380 HydrophobicContact CD2-CG2 3.48Å; L345-I380 VanDerWaalsContact CD2-CG2 3.48Å; L345-L381 HydrophobicContact CD1-CD1 4.1Å; L345-L381 HydrophobicContact CD1-CD2 4.36Å; L345-L381 HydrophobicContact CD1-CG 4.22Å; L345-L381 HydrophobicContact CD2-CG 4.41Å
346	L	95.2	Very high	94.6	Very high	79 Å²	79	40.6 Å²	40.6	41%	0.414	21%	0.209	S	C	.	.	H	α-helix	trans	-62	-40.2	176.5	-75.8	167.3	0	0	0	111.9	M342 E343 R350 I380	M342-L346 HydrophobicContact CG-CD1 3.98Å; M342-L346 WeakPolarHBondContact O-CB 3.35Å; M342-L346 WeakPolarHBondContact O-CG 3.44Å; M342-L346 PolarHBondContact O-N 2.96Å; E343-L346 PolarHBondContact O-N 2.88Å; L346-R350 WeakPolarHBondContact O-CB 3.43Å; L346-R350 PolarHBondContact O-N 2.83Å; L346-I380 HydrophobicContact CD2-CD1 4.29Å; L346-I380 HydrophobicContact CD2-CG2 3.56Å; L346-I380 HydrophobicContact CG-CD1 4.38Å; L346-I380 HydrophobicContact CG-CG2 4.34Å
347	L	94.4	Very high	94.5	Very high	25 Å²	25	42.3 Å²	42.3	13%	0.131	22%	0.217	C	C	.	.	H	α-helix	trans	-67.5	-41.5	178.8	-164.3	93.4	0	0	0	112.3	L312 K313 I316 E343 C344 L345 R350 Y351	L312-L347 HydrophobicContact CB-CD2 4.08Å; L312-L347 HydrophobicContact CD2-CB 4.46Å; L312-L347 HydrophobicContact CD2-CD2 3.81Å; L312-L347 HydrophobicContact CG-CD2 3.73Å; K313-L347 HydrophobicContact CB-CD1 4.38Å; K313-L347 HydrophobicContact CB-CD2 3.84Å; K313-L347 HydrophobicContact CD-CD1 4.37Å; K313-L347 HydrophobicContact CG-CD1 4.45Å; I316-L347 HydrophobicContact CD1-CD2 3.92Å; I316-L347 HydrophobicContact CD1-CG 4.48Å; E343-L347 VanDerWaalsContact O-CB 3.32Å; E343-L347 WeakPolarHBondContact O-CB 3.29Å; E343-L347 PolarHBondContact O-N 3.19Å; C344-L347 PolarHBondContact O-N 3.18Å; L345-L347 VanDerWaalsContact C-N 3.33Å; L345-L347 PolarHBondContact O-N 2.97Å; L347-R350 PolarHBondContact O-N 2.98Å; L347-Y351 HydrophobicContact CD1-CE2 4Å; L347-Y351 HydrophobicContact CG-CD2 4.1Å; L347-Y351 HydrophobicContact CG-CE2 3.98Å; L347-Y351 VanDerWaalsContact O-CD2 3.27Å; L347-Y351 WeakPolarHBondContact O-CD2 3.25Å; L347-Y351 PolarHBondContact O-N 3.27Å
348	L	95.3	Very high	94.4	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-61.4	-48.5	174.7	-77.4	171.8	0	0	0	111.6	I300 L312 I316 L322 P332 L333 C344 L345 Y351 G352 A353	I300-L348 HydrophobicContact CD1-CD2 4.2Å; L312-L348 HydrophobicContact CD1-CD2 4.38Å; L312-L348 HydrophobicContact CD2-CG 4.24Å; I316-L348 HydrophobicContact CD1-CD2 4.39Å; L322-L348 HydrophobicContact CD2-CD2 4.11Å; P332-L348 HydrophobicContact CB-CD1 3.62Å; P332-L348 HydrophobicContact CB-CD2 4.03Å; L333-L348 HydrophobicContact CD2-CB 3.61Å; L333-L348 HydrophobicContact CD2-CD1 3.82Å; L333-L348 HydrophobicContact CD2-CG 4.4Å; L333-L348 HydrophobicContact CG-CB 4.26Å; L333-L348 HydrophobicContact CG-CD1 4.08Å; C344-L348 WeakPolarHBondContact O-CB 3.44Å; C344-L348 VanDerWaalsContact O-CG 3.3Å; C344-L348 WeakPolarHBondContact O-CG 3.45Å; C344-L348 PolarHBondContact O-N 3.21Å; L345-L348 PolarHBondContact O-N 3.25Å; L348-Y351 PolarHBondContact O-N 3.31Å; L348-G352 PolarHBondContact O-N 3.3Å; L348-A353 HydrophobicContact CB-CB 3.75Å; L348-A353 HydrophobicContact CD2-CB 4.31Å; L348-A353 VanDerWaalsContact O-CB 3.25Å; L348-A353 WeakPolarHBondContact O-CB 3.41Å; L348-A353 PolarHBondContact O-N 3Å
349	L	94.4	Very high	94.4	Very high	5 Å²	5	44.6 Å²	44.6	3%	0.026	23%	0.229	C	C	.	.	H	α-helix	trans	-61.5	-45.1	177.9	-71.9	177	0	0	0	111.6	L333 L345 Y351 G352 P355 I380 L381 F384	L333-L349 HydrophobicContact CD1-CD2 4.04Å; L333-L349 HydrophobicContact CD2-CD2 4.01Å; L333-L349 HydrophobicContact CD2-CG 3.98Å; L345-L349 HydrophobicContact CD2-CD1 3.67Å; L345-L349 HydrophobicContact CG-CD1 4.4Å; L345-L349 WeakPolarHBondContact O-CG 3.26Å; L345-L349 PolarHBondContact O-N 2.96Å; L349-Y351 PolarHBondContact O-N 3.49Å; L349-G352 PolarHBondContact O-N 3.43Å; L349-P355 HydrophobicContact CD2-CB 4.28Å; L349-P355 HydrophobicContact CD2-CG 4.46Å; L349-I380 HydrophobicContact CD1-CG2 3.91Å; L349-L381 HydrophobicContact CD1-CD2 4.1Å; L349-L381 HydrophobicContact CD2-CD2 4.25Å; L349-F384 HydrophobicContact CB-CD2 3.81Å; L349-F384 HydrophobicContact CB-CE2 3.65Å; L349-F384 HydrophobicContact CB-CZ 4.35Å; L349-F384 HydrophobicContact CD1-CB 4.46Å; L349-F384 HydrophobicContact CD1-CD2 4.07Å; L349-F384 HydrophobicContact CD1-CG 4.35Å; L349-F384 HydrophobicContact CD2-CD1 4.16Å; L349-F384 HydrophobicContact CD2-CD2 4Å; L349-F384 HydrophobicContact CD2-CE1 4.24Å; L349-F384 HydrophobicContact CD2-CE2 4.11Å; L349-F384 HydrophobicContact CD2-CG 4.01Å; L349-F384 HydrophobicContact CD2-CZ 4.21Å; L349-F384 HydrophobicContact CG-CD2 4.17Å; L349-F384 HydrophobicContact CG-CE2 4.35Å; L349-F384 WeakPolarHBondContact O-CE2 3.3Å
350	R	92.3	Very high	94.5	Very high	111 Å²	111	47.4 Å²	47.4	42%	0.419	25%	0.248	S	C	.	.	H	α-helix	trans	-55.7	-33.3	176.5	178.2	179	179.6	144.3	7.7	113.3	L346 L347 E390	L346-R350 WeakPolarHBondContact O-CB 3.43Å; L346-R350 PolarHBondContact O-N 2.83Å; L347-R350 PolarHBondContact O-N 2.98Å; R350-E390 HydrophobicContact CG-CB 4.24Å; R350-E390 HydrophobicContact CG-CG 4.22Å; R350-E390 VanDerWaalsContact CZ-CD 3.49Å; R350-E390 IonicContact CZ-OE1 3.16Å; R350-E390 IonicContact CZ-OE2 3.12Å; R350-E390 IonicContact NE-OE1 3.3Å; R350-E390 PolarHBondContact NE-OE1 2.73Å; R350-E390 IonicContact NE-OE2 3.07Å; R350-E390 PolarHBondContact NE-OE2 3Å; R350-E390 IonicContact NH2-OE1 2.81Å; R350-E390 PolarHBondContact NH2-OE1 3.13Å; R350-E390 IonicContact NH2-OE2 2.72Å; R350-E390 PolarHBondContact NH2-OE2 3.43Å; R350-E390 PolarHBondContact O-N 2.69Å
351	Y	91.6	Very high	94.4	Very high	30 Å²	30	49.1 Å²	49.1	12%	0.118	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.4	9.2	177.5	-67.8	-58.4	0	0	0	114.3	K313 I316 L322 L347 L348 L349 I392	K313-Y351 WeakPolarHBondContact CE-OH 3.19Å; I316-Y351 HydrophobicContact CD1-CD2 3.85Å; I316-Y351 HydrophobicContact CG2-CD2 3.8Å; I316-Y351 HydrophobicContact CG2-CE2 4.4Å; I316-Y351 HydrophobicContact CG2-CG 3.87Å; L322-Y351 WeakPolarHBondContact CD1-O 3.25Å; L347-Y351 HydrophobicContact CD1-CE2 4Å; L347-Y351 HydrophobicContact CG-CD2 4.1Å; L347-Y351 HydrophobicContact CG-CE2 3.98Å; L347-Y351 VanDerWaalsContact O-CD2 3.27Å; L347-Y351 WeakPolarHBondContact O-CD2 3.25Å; L347-Y351 PolarHBondContact O-N 3.27Å; L348-Y351 PolarHBondContact O-N 3.31Å; L349-Y351 PolarHBondContact O-N 3.49Å; Y351-I392 HydrophobicContact CD1-CG1 3.98Å; Y351-I392 HydrophobicContact CE1-CG1 4.3Å
352	G	91.1	Very high	94.4	Very high	18 Å²	18	48.8 Å²	48.8	19%	0.186	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	88.8	29.1	171.2	0	0	0	0	0	116	L348 L349	L348-G352 PolarHBondContact O-N 3.3Å; L349-G352 PolarHBondContact O-N 3.43Å
353	A	94	Very high	94.4	Very high	1 Å²	1	46.1 Å²	46.1	1%	0.008	26%	0.262	C	S	.	.			trans	-64.1	136.6	164.4	0	0	0	0	0	110.5	L322 L333 L348 P355	L322-A353 HydrophobicContact CB-CB 3.92Å; L322-A353 HydrophobicContact CD1-CB 4.4Å; L333-A353 HydrophobicContact CD1-CB 3.77Å; L333-A353 HydrophobicContact CD2-CB 4.37Å; L333-A353 HydrophobicContact CG-CB 3.94Å; L348-A353 HydrophobicContact CB-CB 3.75Å; L348-A353 HydrophobicContact CD2-CB 4.31Å; L348-A353 VanDerWaalsContact O-CB 3.25Å; L348-A353 WeakPolarHBondContact O-CB 3.41Å; L348-A353 PolarHBondContact O-N 3Å; A353-P355 VanDerWaalsContact O-CD 3.3Å; A353-P355 WeakPolarHBondContact O-CD 3.48Å
354	L	93.7	Very high	94.4	Very high	75 Å²	75	41.5 Å²	41.5	39%	0.393	24%	0.242	S	C	.	.			trans	-84.4	114	-171.4	-63	173.8	0	0	0	111.8	N323 T356 I357	N323-L354 WeakPolarHBondContact OD1-CB 3.16Å; N323-L354 WeakPolarHBondContact OD1-CG 3.42Å; N323-L354 PolarHBondContact OD1-N 2.86Å; L354-T356 PolarHBondContact O-N 3.08Å; L354-I357 HydrophobicContact CB-CD1 3.91Å; L354-I357 HydrophobicContact CB-CG1 4.02Å; L354-I357 HydrophobicContact CD1-CD1 4.25Å
355	P	93.7	Very high	94.4	Very high	22 Å²	22	41.5 Å²	41.5	14%	0.143	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.5	-1.1	178	33.8	-37	0	0	0	113.4	L333 L349 A353 P365 L381 F384	L333-P355 HydrophobicContact CD1-CB 4.37Å; L349-P355 HydrophobicContact CD2-CB 4.28Å; L349-P355 HydrophobicContact CD2-CG 4.46Å; A353-P355 VanDerWaalsContact O-CD 3.3Å; A353-P355 WeakPolarHBondContact O-CD 3.48Å; P355-P365 WeakPolarHBondContact O-CD 3.43Å; P355-L381 HydrophobicContact CB-CD2 4.15Å; P355-F384 HydrophobicContact CG-CD1 3.88Å; P355-F384 HydrophobicContact CG-CE1 4.16Å
356	T	93.6	Very high	94.4	Very high	96 Å²	96	45.2 Å²	45.2	59%	0.589	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.4	-8.1	-175.7	51.5	0	0	0	0	114.2	L354	L354-T356 PolarHBondContact O-N 3.08Å
357	I	94.3	Very high	94.4	Very high	36 Å²	36	45.9 Å²	45.9	19%	0.185	26%	0.257	C	S	.	.			trans	-70.8	139.1	177.2	-61.9	171.4	0	0	0	109.4	N323 Q325 T331 H334 L354 P365	N323-I357 HydrophobicContact CB-CD1 3.77Å; Q325-I357 VanDerWaalsContact NE2-CG2 3.35Å; T331-I357 HydrophobicContact CG2-CB 4Å; T331-I357 HydrophobicContact CG2-CD1 3.96Å; T331-I357 HydrophobicContact CG2-CG2 3.57Å; H334-I357 PolarHBondContact CE1-O 2.91Å; L354-I357 HydrophobicContact CB-CD1 3.91Å; L354-I357 HydrophobicContact CB-CG1 4.02Å; L354-I357 HydrophobicContact CD1-CD1 4.25Å; I357-P365 WeakPolarHBondContact O-CD 3.35Å
358	I	95.5	Very high	94.5	Very high	93 Å²	93	45.1 Å²	45.1	48%	0.477	25%	0.253	S	S	.	.			trans	-101.6	149.9	175.6	58.7	173.2	0	0	0	112.5	Q325 Q363 T364	Q325-I358 PolarHBondContact NE2-O 3.22Å; I358-Q363 CarbonylContact C-O 3.52Å; I358-Q363 VanDerWaalsContact CA-O 3.29Å; I358-Q363 WeakPolarHBondContact CA-O 3.32Å; I358-T364 HydrophobicContact CG2-CG2 3.84Å
359	N	95.1	Very high	94.6	Very high	11 Å²	11	45.1 Å²	45.1	6%	0.059	25%	0.253	C	S	.	.			trans	-88.5	-178.4	171.3	71.3	11.8	0	0	0	113	N330 S361 G362 Q363	N330-N359 WeakPolarHBondContact OD1-CB 3.34Å; N330-N359 PolarHBondContact OD1-ND2 2.83Å; N359-S361 PolarHBondContact O-N 3.16Å; N359-S361 VanDerWaalsContact O-N 3.13Å; N359-S361 WeakPolarHBondContact OD1-CA 3.4Å; N359-S361 VanDerWaalsContact OD1-CB 3.29Å; N359-S361 WeakPolarHBondContact OD1-CB 3.25Å; N359-S361 PolarHBondContact OD1-N 3.41Å; N359-G362 PolarHBondContact O-N 2.92Å; N359-G362 PolarHBondContact OD1-N 3.04Å; N359-Q363 PolarHBondContact N-O 2.8Å; N359-Q363 PolarHBondContact OD1-N 3.42Å; N359-Q363 PolarHBondContact OD1-O 3.01Å
360	S	95.2	Very high	94.7	Very high	70 Å²	70	48.2 Å²	48.2	49%	0.49	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-14.9	180	-61.8	0	0	0	0	114.4	N328 H329 G362	N328-S360 WeakPolarHBondContact CA-OG 3.37Å; N328-S360 PolarHBondContact O-N 3.22Å; N328-S360 PolarHBondContact O-OG 3.2Å; N328-S360 VanDerWaalsContact O-OG 3.13Å; H329-S360 PolarHBondContact CD2-OG 3.3Å; H329-S360 VanDerWaalsContact CD2-OG 3.29Å; S360-G362 VanDerWaalsContact C-N 3.3Å
361	S	94.1	Very high	94.8	Very high	89 Å²	89	47.3 Å²	47.3	62%	0.622	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.3	0.3	172.3	-53.4	0	0	0	0	112.8	N359 Q363	N359-S361 PolarHBondContact O-N 3.16Å; N359-S361 VanDerWaalsContact O-N 3.13Å; N359-S361 WeakPolarHBondContact OD1-CA 3.4Å; N359-S361 VanDerWaalsContact OD1-CB 3.29Å; N359-S361 WeakPolarHBondContact OD1-CB 3.25Å; N359-S361 PolarHBondContact OD1-N 3.41Å; S361-Q363 VanDerWaalsContact C-N 3.32Å
362	G	94.5	Very high	94.9	Very high	47 Å²	47	46.7 Å²	46.7	49%	0.485	27%	0.27	S	S	.	.	S	Bend	trans	74.7	18.1	-174.7	0	0	0	0	0	114.2	N359 S360	N359-G362 PolarHBondContact O-N 2.92Å; N359-G362 PolarHBondContact OD1-N 3.04Å; S360-G362 VanDerWaalsContact C-N 3.3Å
363	Q	95.3	Very high	95.1	Very high	40 Å²	40	50.6 Å²	50.6	19%	0.187	28%	0.284	C	S	.	.			trans	-105.3	139.2	-175.1	-60.9	166.1	-34.8	0	0	110.8	H334 I358 N359 S361 E367	H334-Q363 PolarHBondContact NE2-O 3.21Å; I358-Q363 CarbonylContact C-O 3.52Å; I358-Q363 VanDerWaalsContact CA-O 3.29Å; I358-Q363 WeakPolarHBondContact CA-O 3.32Å; N359-Q363 PolarHBondContact N-O 2.8Å; N359-Q363 PolarHBondContact OD1-N 3.42Å; N359-Q363 PolarHBondContact OD1-O 3.01Å; S361-Q363 VanDerWaalsContact C-N 3.32Å; Q363-E367 HydrophobicContact CB-CB 4.43Å
364	T	96.6	Very high	95.1	Very high	24 Å²	24	53 Å²	53	15%	0.147	29%	0.293	C	S	.	.			trans	-76.5	166.9	162.8	59.3	0	0	0	0	111.7	I358 Y366 E367 L368	I358-T364 HydrophobicContact CG2-CG2 3.84Å; T364-Y366 PolarHBondContact O-N 2.93Å; T364-E367 WeakPolarHBondContact CB-OE2 3.47Å; T364-E367 WeakPolarHBondContact CG2-OE2 3.14Å; T364-E367 PolarHBondContact N-OE2 2.99Å; T364-E367 PolarHBondContact O-N 3.42Å; T364-E367 WeakPolarHBondContact OG1-CG 3.15Å; T364-E367 PolarHBondContact OG1-N 3.18Å; T364-E367 PolarHBondContact OG1-OE2 3.4Å; T364-L368 WeakPolarHBondContact O-CB 3.38Å; T364-L368 PolarHBondContact O-N 3.42Å
365	P	95.8	Very high	95	Very high	0 Å²	0	54.1 Å²	54.1	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-56.2	-32.9	170.3	-23.9	33.5	0	0	0	113.2	L333 H334 V337 P355 I357 A369 L381	L333-P365 HydrophobicContact CB-CB 4.19Å; L333-P365 HydrophobicContact CB-CG 3.81Å; H334-P365 WeakPolarHBondContact NE2-CD 3.44Å; V337-P365 HydrophobicContact CG2-CB 4.16Å; P355-P365 WeakPolarHBondContact O-CD 3.43Å; I357-P365 WeakPolarHBondContact O-CD 3.35Å; P365-A369 VanDerWaalsContact O-CB 3.32Å; P365-A369 WeakPolarHBondContact O-CB 3.49Å; P365-A369 PolarHBondContact O-N 2.69Å; P365-L381 HydrophobicContact CB-CD1 3.95Å; P365-L381 HydrophobicContact CB-CD2 4.3Å
366	Y	96.6	Very high	95.1	Very high	77 Å²	77	58.3 Å²	58.3	30%	0.302	32%	0.319	S	S	.	.	H	α-helix	trans	-68.8	-49.9	178.3	172.1	-106	0	0	0	111.6	T364 L368 A369 I370 A378 L381 Q382	T364-Y366 PolarHBondContact O-N 2.93Å; Y366-L368 VanDerWaalsContact C-N 3.29Å; Y366-L368 PolarHBondContact O-N 3.09Å; Y366-A369 WeakPolarHBondContact O-CB 3.42Å; Y366-A369 PolarHBondContact O-N 3.22Å; Y366-A369 VanDerWaalsContact O-N 3.11Å; Y366-I370 HydrophobicContact CE1-CG1 4.29Å; Y366-I370 HydrophobicContact CE2-CD1 4.24Å; Y366-I370 HydrophobicContact CE2-CG1 4.12Å; Y366-I370 WeakPolarHBondContact O-CG1 3.22Å; Y366-I370 PolarHBondContact O-N 3.45Å; Y366-A378 HydrophobicContact CD2-CB 4.24Å; Y366-A378 WeakPolarHBondContact CD2-O 3.04Å; Y366-A378 HydrophobicContact CE2-CB 4.08Å; Y366-A378 WeakPolarHBondContact CE2-O 3.42Å; Y366-L381 HydrophobicContact CD2-CB 4.2Å; Y366-Q382 HydrophobicContact CD2-CB 4.23Å; Y366-Q382 HydrophobicContact CE2-CB 3.75Å; Y366-Q382 HydrophobicContact CE2-CG 4.35Å; Y366-Q382 PolarHBondContact OH-OE1 3.4Å
367	E	96.1	Very high	95.2	Very high	94 Å²	94	54 Å²	54	44%	0.439	29%	0.292	S	S	.	.	H	α-helix	trans	-63.9	-37.2	178.3	-68	158.9	131.8	0	0	111.4	Q363 T364 I370 L371	Q363-E367 HydrophobicContact CB-CB 4.43Å; T364-E367 WeakPolarHBondContact CB-OE2 3.47Å; T364-E367 WeakPolarHBondContact CG2-OE2 3.14Å; T364-E367 PolarHBondContact N-OE2 2.99Å; T364-E367 PolarHBondContact O-N 3.42Å; T364-E367 WeakPolarHBondContact OG1-CG 3.15Å; T364-E367 PolarHBondContact OG1-N 3.18Å; T364-E367 PolarHBondContact OG1-OE2 3.4Å; E367-I370 PolarHBondContact O-N 3.05Å; E367-L371 WeakPolarHBondContact O-CB 3.16Å; E367-L371 PolarHBondContact O-N 3.32Å
368	L	95.8	Very high	95.2	Very high	9 Å²	9	52.3 Å²	52.3	5%	0.047	28%	0.283	C	S	.	.	H	α-helix	trans	-64.1	-39.6	172.7	-173.1	63.2	0	0	0	112	H334 V337 L338 T364 Y366 L371 I372	H334-L368 HydrophobicContact CB-CD2 4.16Å; V337-L368 HydrophobicContact CG1-CB 4.06Å; V337-L368 HydrophobicContact CG1-CD2 4.08Å; V337-L368 HydrophobicContact CG1-CG 3.87Å; L338-L368 HydrophobicContact CD1-CD2 4.2Å; L338-L368 HydrophobicContact CD2-CD2 4.35Å; L338-L368 HydrophobicContact CG-CD2 4.02Å; T364-L368 WeakPolarHBondContact O-CB 3.38Å; T364-L368 PolarHBondContact O-N 3.42Å; Y366-L368 VanDerWaalsContact C-N 3.29Å; Y366-L368 PolarHBondContact O-N 3.09Å; L368-L371 HydrophobicContact CD1-CD2 4.43Å; L368-L371 PolarHBondContact O-N 2.94Å; L368-I372 HydrophobicContact CD1-CD1 3.71Å; L368-I372 HydrophobicContact CD1-CG1 4.29Å; L368-I372 HydrophobicContact CG-CD1 3.95Å; L368-I372 WeakPolarHBondContact O-CG1 3.11Å; L368-I372 PolarHBondContact O-N 3.06Å
369	A	96.8	Very high	95.2	Very high	0 Å²	0	53.3 Å²	53.3	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-65.7	-38.8	176.3	0	0	0	0	0	111.9	V337 P365 Y366 E373 R374 L377 A378 L381	V337-A369 HydrophobicContact CG1-CB 3.72Å; V337-A369 HydrophobicContact CG2-CB 4.28Å; P365-A369 VanDerWaalsContact O-CB 3.32Å; P365-A369 WeakPolarHBondContact O-CB 3.49Å; P365-A369 PolarHBondContact O-N 2.69Å; Y366-A369 WeakPolarHBondContact O-CB 3.42Å; Y366-A369 PolarHBondContact O-N 3.22Å; Y366-A369 VanDerWaalsContact O-N 3.11Å; A369-E373 PolarHBondContact O-N 3.34Å; A369-R374 PolarHBondContact O-N 2.81Å; A369-L377 HydrophobicContact CB-CB 4.48Å; A369-A378 HydrophobicContact CB-CB 3.88Å; A369-L381 HydrophobicContact CB-CD1 4.31Å
370	I	96.2	Very high	95.2	Very high	70 Å²	70	54.6 Å²	54.6	36%	0.359	29%	0.291	S	S	.	.	H	α-helix	trans	-64.8	-46.8	172.2	-64.5	-65.1	0	0	0	110.9	Y366 E367 I372 E373 M375 A378	Y366-I370 HydrophobicContact CE1-CG1 4.29Å; Y366-I370 HydrophobicContact CE2-CD1 4.24Å; Y366-I370 HydrophobicContact CE2-CG1 4.12Å; Y366-I370 WeakPolarHBondContact O-CG1 3.22Å; Y366-I370 PolarHBondContact O-N 3.45Å; E367-I370 PolarHBondContact O-N 3.05Å; I370-I372 VanDerWaalsContact C-N 3.28Å; I370-I372 PolarHBondContact O-N 3.31Å; I370-E373 PolarHBondContact O-N 3.44Å; I370-M375 HydrophobicContact CD1-CE 4.02Å; I370-M375 HydrophobicContact CD1-SD 4.07Å; I370-A378 HydrophobicContact CD1-CB 3.64Å; I370-A378 HydrophobicContact CG1-CB 4.16Å
371	L	94.7	Very high	95.1	Very high	92 Å²	92	51.9 Å²	51.9	48%	0.482	27%	0.27	S	S	.	.	H	α-helix	trans	-62.6	-29.9	-178.8	-172.1	113.4	0	0	0	113.7	E367 L368	E367-L371 WeakPolarHBondContact O-CB 3.16Å; E367-L371 PolarHBondContact O-N 3.32Å; L368-L371 HydrophobicContact CD1-CD2 4.43Å; L368-L371 PolarHBondContact O-N 2.94Å
372	I	94.6	Very high	95.1	Very high	16 Å²	16	53.4 Å²	53.4	8%	0.082	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.2	3.1	177.8	-55.8	176	0	0	0	111.4	L338 L368 I370 R374 R704	L338-I372 HydrophobicContact CD2-CD1 3.57Å; L368-I372 HydrophobicContact CD1-CD1 3.71Å; L368-I372 HydrophobicContact CD1-CG1 4.29Å; L368-I372 HydrophobicContact CG-CD1 3.95Å; L368-I372 WeakPolarHBondContact O-CG1 3.11Å; L368-I372 PolarHBondContact O-N 3.06Å; I370-I372 VanDerWaalsContact C-N 3.28Å; I370-I372 PolarHBondContact O-N 3.31Å; I372-R374 VanDerWaalsContact C-N 3.27Å; I372-R374 HydrophobicContact CB-CG 4.4Å; I372-R374 HydrophobicContact CG2-CG 4.08Å; I372-R374 PolarHBondContact O-N 2.92Å; I372-R704 PolarHBondContact O-NH2 2.81Å
373	E	93.8	Very high	94.9	Very high	101 Å²	101	57.2 Å²	57.2	47%	0.472	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	62.5	26.2	-178.8	-52.1	172.6	146.7	0	0	114.1	A369 I370 M375 F702 R704	A369-E373 PolarHBondContact O-N 3.34Å; I370-E373 PolarHBondContact O-N 3.44Å; E373-M375 PolarHBondContact O-N 3.13Å; E373-F702 HydrophobicContact CG-CE1 4.03Å; E373-F702 HydrophobicContact CG-CZ 4.25Å; E373-F702 WeakPolarHBondContact OE1-CZ 3.21Å; E373-R704 IonicContact OE2-CZ 2.96Å; E373-R704 IonicContact OE2-NH1 2.77Å; E373-R704 PolarHBondContact OE2-NH1 3.21Å; E373-R704 IonicContact OE2-NH2 2.8Å; E373-R704 PolarHBondContact OE2-NH2 3.39Å
374	R	94.4	Very high	94.5	Very high	52 Å²	52	57.5 Å²	57.5	20%	0.196	28%	0.278	C	S	.	.			trans	-84.7	61.3	179.6	-67.2	179.6	-179.2	-161.9	-2.4	110.9	V337 L338 D340 A369 I372 N376 L377 A378	V337-R374 WeakPolarHBondContact O-CD 3.44Å; V337-R374 PolarHBondContact O-NH1 3.27Å; L338-R374 VanDerWaalsContact O-CZ 3.3Å; L338-R374 PolarHBondContact O-NH1 3.1Å; L338-R374 PolarHBondContact O-NH2 2.84Å; D340-R374 WeakPolarHBondContact OD1-CD 3.47Å; D340-R374 IonicContact OD1-CZ 3.15Å; D340-R374 IonicContact OD1-NE 2.76Å; D340-R374 IonicContact OD1-NH1 3.44Å; A369-R374 PolarHBondContact O-N 2.81Å; I372-R374 VanDerWaalsContact C-N 3.27Å; I372-R374 HydrophobicContact CB-CG 4.4Å; I372-R374 HydrophobicContact CG2-CG 4.08Å; I372-R374 PolarHBondContact O-N 2.92Å; R374-N376 PolarHBondContact O-N 3.43Å; R374-L377 HydrophobicContact CB-CB 4.49Å; R374-L377 HydrophobicContact CB-CD1 4.42Å; R374-L377 PolarHBondContact O-N 2.76Å; R374-A378 PolarHBondContact O-N 3.06Å
375	M	92.8	Very high	94	Very high	97 Å²	97	59.7 Å²	59.7	48%	0.478	29%	0.289	S	S	.	.	H	α-helix	trans	-56.7	-25.7	-170.8	-59.7	-53	-66.7	0	0	114.4	I370 E373 K379	I370-M375 HydrophobicContact CD1-CE 4.02Å; I370-M375 HydrophobicContact CD1-SD 4.07Å; E373-M375 PolarHBondContact O-N 3.13Å; M375-K379 WeakPolarHBondContact O-CD 3.25Å; M375-K379 WeakPolarHBondContact O-CG 3.48Å; M375-K379 PolarHBondContact O-N 3.47Å; M375-K379 VanDerWaalsContact O-N 3.09Å
376	N	94.6	Very high	93.4	Very high	111 Å²	111	65.4 Å²	65.4	59%	0.594	32%	0.315	S	S	*	.	H	α-helix	trans	-71.7	-45.2	175.4	-68	-12.4	0	0	0	111.8	R374 K379 I380	R374-N376 PolarHBondContact O-N 3.43Å; N376-K379 PolarHBondContact O-N 2.79Å; N376-I380 WeakPolarHBondContact O-CG1 3.22Å; N376-I380 PolarHBondContact O-N 3.42Å
377	L	95.7	Very high	92.7	Very high	4 Å²	4	68.3 Å²	68.3	2%	0.021	34%	0.336	C	S	.	.	H	α-helix	trans	-68.6	-37.9	175.3	-55.9	-175.3	0	0	0	111.2	V337 M342 L345 A369 R374 K379 I380 L381	V337-L377 HydrophobicContact CG2-CD1 4.48Å; M342-L377 HydrophobicContact CB-CD2 3.8Å; M342-L377 HydrophobicContact CG-CD2 3.98Å; L345-L377 HydrophobicContact CD1-CB 4.23Å; L345-L377 HydrophobicContact CD1-CD1 4.42Å; L345-L377 HydrophobicContact CD1-CD2 4.36Å; A369-L377 HydrophobicContact CB-CB 4.48Å; R374-L377 HydrophobicContact CB-CB 4.49Å; R374-L377 HydrophobicContact CB-CD1 4.42Å; R374-L377 PolarHBondContact O-N 2.76Å; L377-K379 VanDerWaalsContact C-N 3.35Å; L377-K379 PolarHBondContact O-N 3.01Å; L377-I380 HydrophobicContact CD2-CD1 4.48Å; L377-I380 PolarHBondContact O-N 3.32Å; L377-L381 WeakPolarHBondContact O-CG 3.35Å; L377-L381 PolarHBondContact O-N 2.99Å
378	A	95.9	Very high	91.9	Very high	1 Å²	1	69.8 Å²	69.8	1%	0.008	35%	0.346	C	S	.	.	H	α-helix	trans	-59.8	-42.3	174.9	0	0	0	0	0	112.2	Y366 A369 I370 R374 L381 Q382	Y366-A378 HydrophobicContact CD2-CB 4.24Å; Y366-A378 WeakPolarHBondContact CD2-O 3.04Å; Y366-A378 HydrophobicContact CE2-CB 4.08Å; Y366-A378 WeakPolarHBondContact CE2-O 3.42Å; A369-A378 HydrophobicContact CB-CB 3.88Å; I370-A378 HydrophobicContact CD1-CB 3.64Å; I370-A378 HydrophobicContact CG1-CB 4.16Å; R374-A378 PolarHBondContact O-N 3.06Å; A378-L381 PolarHBondContact O-N 3.44Å; A378-Q382 VanDerWaalsContact O-CB 3.24Å; A378-Q382 WeakPolarHBondContact O-CB 3.32Å; A378-Q382 PolarHBondContact O-N 2.94Å
379	K	94.7	Very high	91.4	Very high	114 Å²	114	72.4 Å²	72.4	50%	0.496	36%	0.36	S	S	.	.	H	α-helix	trans	-62	-40.8	173.7	-74.5	164.7	-174.6	173.7	0	112.7	M375 N376 L377 Q382 N383	M375-K379 WeakPolarHBondContact O-CD 3.25Å; M375-K379 WeakPolarHBondContact O-CG 3.48Å; M375-K379 PolarHBondContact O-N 3.47Å; M375-K379 VanDerWaalsContact O-N 3.09Å; N376-K379 PolarHBondContact O-N 2.79Å; L377-K379 VanDerWaalsContact C-N 3.35Å; L377-K379 PolarHBondContact O-N 3.01Å; K379-Q382 PolarHBondContact O-N 2.78Å; K379-N383 VanDerWaalsContact O-CB 3.28Å; K379-N383 WeakPolarHBondContact O-CB 3.19Å; K379-N383 VanDerWaalsContact O-CG 3.27Å; K379-N383 PolarHBondContact O-N 3.19Å
380	I	94.4	Very high	90.7	Very high	38 Å²	38	76.1 Å²	76.1	20%	0.195	38%	0.377	C	S	.	.	H	α-helix	trans	-65	-44.8	178.3	-66.6	165.6	0	0	0	110.3	M342 L345 L346 L349 N376 L377 N383 F384	M342-I380 HydrophobicContact CG-CD1 3.68Å; M342-I380 HydrophobicContact SD-CD1 3.97Å; L345-I380 HydrophobicContact CD2-CB 4.11Å; L345-I380 HydrophobicContact CD2-CG2 3.48Å; L345-I380 VanDerWaalsContact CD2-CG2 3.48Å; L346-I380 HydrophobicContact CD2-CD1 4.29Å; L346-I380 HydrophobicContact CD2-CG2 3.56Å; L346-I380 HydrophobicContact CG-CD1 4.38Å; L346-I380 HydrophobicContact CG-CG2 4.34Å; L349-I380 HydrophobicContact CD1-CG2 3.91Å; N376-I380 WeakPolarHBondContact O-CG1 3.22Å; N376-I380 PolarHBondContact O-N 3.42Å; L377-I380 HydrophobicContact CD2-CD1 4.48Å; L377-I380 PolarHBondContact O-N 3.32Å; I380-N383 PolarHBondContact O-N 2.92Å; I380-F384 PolarHBondContact O-N 2.88Å; I380-F384 VanDerWaalsContact O-N 3.16Å
381	L	94.3	Very high	89.8	Confident	13 Å²	13	75.1 Å²	75.1	7%	0.068	38%	0.384	C	S	.	.	H	α-helix	trans	-67.5	-34.5	177.4	-71	163.6	0	0	0	112.9	V337 L345 L349 P355 P365 Y366 A369 L377 A378	V337-L381 HydrophobicContact CG2-CD1 3.81Å; L345-L381 HydrophobicContact CD1-CD1 4.1Å; L345-L381 HydrophobicContact CD1-CD2 4.36Å; L345-L381 HydrophobicContact CD1-CG 4.22Å; L345-L381 HydrophobicContact CD2-CG 4.41Å; L349-L381 HydrophobicContact CD1-CD2 4.1Å; L349-L381 HydrophobicContact CD2-CD2 4.25Å; P355-L381 HydrophobicContact CB-CD2 4.15Å; P365-L381 HydrophobicContact CB-CD1 3.95Å; P365-L381 HydrophobicContact CB-CD2 4.3Å; Y366-L381 HydrophobicContact CD2-CB 4.2Å; A369-L381 HydrophobicContact CB-CD1 4.31Å; L377-L381 WeakPolarHBondContact O-CG 3.35Å; L377-L381 PolarHBondContact O-N 2.99Å; A378-L381 PolarHBondContact O-N 3.44Å
382	Q	92.7	Very high	89.1	Confident	122 Å²	122	74.7 Å²	74.7	57%	0.57	38%	0.381	S	S	*	.	H	α-helix	trans	-73	-35.4	177.1	-175.6	172	11.1	0	0	113	Y366 A378 K379 F384	Y366-Q382 HydrophobicContact CD2-CB 4.23Å; Y366-Q382 HydrophobicContact CE2-CB 3.75Å; Y366-Q382 HydrophobicContact CE2-CG 4.35Å; Y366-Q382 PolarHBondContact OH-OE1 3.4Å; A378-Q382 VanDerWaalsContact O-CB 3.24Å; A378-Q382 WeakPolarHBondContact O-CB 3.32Å; A378-Q382 PolarHBondContact O-N 2.94Å; K379-Q382 PolarHBondContact O-N 2.78Å; Q382-F384 VanDerWaalsContact C-N 3.34Å
383	N	90	Very high	88.3	Confident	126 Å²	126	80.9 Å²	80.9	67%	0.674	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.5	13.9	-179.2	-62.1	-12	0	0	0	112.5	K379 I380 D385	K379-N383 VanDerWaalsContact O-CB 3.28Å; K379-N383 WeakPolarHBondContact O-CB 3.19Å; K379-N383 VanDerWaalsContact O-CG 3.27Å; K379-N383 PolarHBondContact O-N 3.19Å; I380-N383 PolarHBondContact O-N 2.92Å; N383-D385 PolarHBondContact O-N 3.28Å
384	F	88.4	Confident	87.6	Confident	46 Å²	46	81.7 Å²	81.7	20%	0.202	42%	0.418	C	S	.	.			trans	-72.7	123.9	177.4	175.8	-111.6	0	0	0	110.5	L349 P355 I380 Q382 E386 I389	L349-F384 HydrophobicContact CB-CD2 3.81Å; L349-F384 HydrophobicContact CB-CE2 3.65Å; L349-F384 HydrophobicContact CB-CZ 4.35Å; L349-F384 HydrophobicContact CD1-CB 4.46Å; L349-F384 HydrophobicContact CD1-CD2 4.07Å; L349-F384 HydrophobicContact CD1-CG 4.35Å; L349-F384 HydrophobicContact CD2-CD1 4.16Å; L349-F384 HydrophobicContact CD2-CD2 4Å; L349-F384 HydrophobicContact CD2-CE1 4.24Å; L349-F384 HydrophobicContact CD2-CE2 4.11Å; L349-F384 HydrophobicContact CD2-CG 4.01Å; L349-F384 HydrophobicContact CD2-CZ 4.21Å; L349-F384 HydrophobicContact CG-CD2 4.17Å; L349-F384 HydrophobicContact CG-CE2 4.35Å; L349-F384 WeakPolarHBondContact O-CE2 3.3Å; P355-F384 HydrophobicContact CG-CD1 3.88Å; P355-F384 HydrophobicContact CG-CE1 4.16Å; I380-F384 PolarHBondContact O-N 2.88Å; I380-F384 VanDerWaalsContact O-N 3.16Å; Q382-F384 VanDerWaalsContact C-N 3.34Å; F384-E386 HydrophobicContact CE1-CG 3.91Å; F384-I389 HydrophobicContact CE2-CG1 4.44Å; F384-I389 HydrophobicContact CZ-CD1 4.1Å; F384-I389 HydrophobicContact CZ-CG1 3.87Å
385	D	85.6	Confident	86.9	Confident	71 Å²	71	86.9 Å²	86.9	38%	0.38	44%	0.442	S	S	.	.			trans	-107.4	121	174.1	-178.4	2.8	0	0	0	109.1	N383 N387 L388	N383-D385 PolarHBondContact O-N 3.28Å; D385-N387 PolarHBondContact O-N 2.78Å; D385-N387 VanDerWaalsContact O-N 3.13Å; D385-N387 WeakPolarHBondContact OD1-CB 3.45Å; D385-N387 PolarHBondContact OD1-N 3.06Å; D385-N387 PolarHBondContact OD1-ND2 3.4Å; D385-L388 HydrophobicContact CB-CD1 4.1Å; D385-L388 HydrophobicContact CB-CG 4.14Å; D385-L388 WeakPolarHBondContact O-CB 2.96Å; D385-L388 PolarHBondContact O-N 2.76Å
386	E	84.1	Confident	86.6	Confident	119 Å²	119	83.3 Å²	83.3	56%	0.556	43%	0.426	S	S	*	.	G	3₁₀ helix	trans	-60.5	-19.9	177	-65.2	-175.9	178.3	0	0	112.5	F384 L388 I389	F384-E386 HydrophobicContact CE1-CG 3.91Å; E386-L388 PolarHBondContact O-N 3.04Å; E386-I389 HydrophobicContact CB-CD1 4.2Å; E386-I389 WeakPolarHBondContact O-CD1 3.33Å; E386-I389 VanDerWaalsContact O-CG1 3.32Å; E386-I389 WeakPolarHBondContact O-CG1 3.29Å; E386-I389 PolarHBondContact O-N 2.85Å
387	N	80.8	Confident	86.2	Confident	138 Å²	138	82.4 Å²	82.4	74%	0.738	43%	0.425	S	S	*	.	G	3₁₀ helix	trans	-73	-9.8	174.2	-59.1	-78.4	0	0	0	113.6	D385	D385-N387 PolarHBondContact O-N 2.78Å; D385-N387 VanDerWaalsContact O-N 3.13Å; D385-N387 WeakPolarHBondContact OD1-CB 3.45Å; D385-N387 PolarHBondContact OD1-N 3.06Å; D385-N387 PolarHBondContact OD1-ND2 3.4Å
388	L	80.4	Confident	85.8	Confident	125 Å²	125	83.5 Å²	83.5	65%	0.654	43%	0.428	S	S	*	.	G	3₁₀ helix	trans	-95.1	7.4	175.7	-62.3	176.1	0	0	0	113.4	D385 E386 E390	D385-L388 HydrophobicContact CB-CD1 4.1Å; D385-L388 HydrophobicContact CB-CG 4.14Å; D385-L388 WeakPolarHBondContact O-CB 2.96Å; D385-L388 PolarHBondContact O-N 2.76Å; E386-L388 PolarHBondContact O-N 3.04Å; L388-E390 PolarHBondContact O-N 3.01Å
389	I	84.2	Confident	85.4	Confident	64 Å²	64	84.4 Å²	84.4	33%	0.328	43%	0.433	S	S	.	.	P	Polyproline II helix	trans	-69.3	123.4	175.2	-64.2	168.6	0	0	0	109.6	F384 E386	F384-I389 HydrophobicContact CE2-CG1 4.44Å; F384-I389 HydrophobicContact CZ-CD1 4.1Å; F384-I389 HydrophobicContact CZ-CG1 3.87Å; E386-I389 HydrophobicContact CB-CD1 4.2Å; E386-I389 WeakPolarHBondContact O-CD1 3.33Å; E386-I389 VanDerWaalsContact O-CG1 3.32Å; E386-I389 WeakPolarHBondContact O-CG1 3.29Å; E386-I389 PolarHBondContact O-N 2.85Å
390	E	83	Confident	84.9	Confident	79 Å²	79	87.6 Å²	87.6	37%	0.369	45%	0.447	S	S	.	.	P	Polyproline II helix	trans	-90.1	148.5	176	-72.2	-177.9	-167.2	0	0	112.2	R350 L388	R350-E390 HydrophobicContact CG-CB 4.24Å; R350-E390 HydrophobicContact CG-CG 4.22Å; R350-E390 VanDerWaalsContact CZ-CD 3.49Å; R350-E390 IonicContact CZ-OE1 3.16Å; R350-E390 IonicContact CZ-OE2 3.12Å; R350-E390 IonicContact NE-OE1 3.3Å; R350-E390 PolarHBondContact NE-OE1 2.73Å; R350-E390 IonicContact NE-OE2 3.07Å; R350-E390 PolarHBondContact NE-OE2 3Å; R350-E390 IonicContact NH2-OE1 2.81Å; R350-E390 PolarHBondContact NH2-OE1 3.13Å; R350-E390 IonicContact NH2-OE2 2.72Å; R350-E390 PolarHBondContact NH2-OE2 3.43Å; R350-E390 PolarHBondContact O-N 2.69Å; L388-E390 PolarHBondContact O-N 3.01Å
391	G	76	Confident	84.1	Confident	48 Å²	48	92.5 Å²	92.5	50%	0.495	47%	0.474	S	S	.	.	P	Polyproline II helix	trans	-70.4	156.6	167.2	0	0	0	0	0	112.3	D393	G391-D393 VanDerWaalsContact C-N 3.33Å; G391-D393 PolarHBondContact O-N 3.21Å
392	I	81.1	Confident	83.1	Confident	83 Å²	83	93.6 Å²	93.6	43%	0.426	48%	0.477	S	S	.	.			trans	-80.7	84.6	169.1	-55.1	177	0	0	0	108.1	I316 I317 Y351 Q394	I316-I392 HydrophobicContact CG2-CD1 3.86Å; I316-I392 HydrophobicContact CG2-CG1 4.43Å; I317-I392 HydrophobicContact CG1-CG2 4.19Å; Y351-I392 HydrophobicContact CD1-CG1 3.98Å; Y351-I392 HydrophobicContact CE1-CG1 4.3Å; I392-Q394 WeakPolarHBondContact CG2-O 3.35Å; I392-Q394 PolarHBondContact O-N 2.94Å
393	D	76.9	Confident	81.8	Confident	146 Å²	146	92.6 Å²	92.6	78%	0.781	47%	0.468	S	S	*	.			trans	-59.9	-33.6	179.7	-68.6	-27.1	0	0	0	113	G391 K395	G391-D393 VanDerWaalsContact C-N 3.33Å; G391-D393 PolarHBondContact O-N 3.21Å; D393-K395 PolarHBondContact O-N 2.82Å
394	Q	78.6	Confident	80.3	Confident	119 Å²	119	88.7 Å²	88.7	56%	0.556	45%	0.45	S	S	*	.	S	Bend	trans	-86.2	104.6	-177.9	-63.9	-173.5	-1.9	0	0	110	I317 I392	I317-Q394 HydrophobicContact CD1-CB 4.21Å; I317-Q394 HydrophobicContact CG1-CB 4.39Å; I392-Q394 WeakPolarHBondContact CG2-O 3.35Å; I392-Q394 PolarHBondContact O-N 2.94Å
395	K	81.6	Confident	78.7	Confident	161 Å²	161	88 Å²	88	70%	0.7	45%	0.449	S	S	*	.			trans	-66.7	137	173.2	-64.8	-177.8	179.7	179.8	0	110.3	D393	D393-K395 PolarHBondContact O-N 2.82Å
396	P	84.9	Confident	77	Confident	21 Å²	21	88.4 Å²	88.4	14%	0.136	45%	0.45	C	S	.	.			trans	-62.3	139.2	176.1	25	-32.6	0	0	0	110.7	I317 Y318 Y398 Y413	I317-P396 HydrophobicContact CG2-CB 4.42Å; I317-P396 WeakPolarHBondContact O-CD 3.47Å; Y318-P396 HydrophobicContact CD1-CB 3.71Å; Y318-P396 HydrophobicContact CD2-CB 4.33Å; Y318-P396 HydrophobicContact CE1-CB 3.96Å; Y318-P396 HydrophobicContact CG-CB 3.94Å; P396-Y398 HydrophobicContact CB-CE2 3.9Å; P396-Y398 HydrophobicContact CG-CE2 3.94Å; P396-Y413 HydrophobicContact CG-CD2 4Å; P396-Y413 HydrophobicContact CG-CE2 3.71Å
397	V	87.7	Confident	75.4	Confident	93 Å²	93	88.1 Å²	88.1	56%	0.564	45%	0.449	S	S	*	.			trans	-108.1	121.8	-179.1	-174.3	0	0	0	0	108.1	Y284 Y318	Y284-V397 HydrophobicContact CD2-CG1 4.25Å; Y284-V397 VanDerWaalsContact CD2-O 3.25Å; Y284-V397 WeakPolarHBondContact CD2-O 3.26Å; Y284-V397 HydrophobicContact CE2-CG1 4Å; Y318-V397 PolarHBondContact OH-O 2.64Å
398	Y	86.1	Confident	73.9	Confident	26 Å²	26	81.6 Å²	81.6	10%	0.102	41%	0.414	C	S	.	.			trans	-110.9	148.8	-179.7	-64.5	-75.1	0	0	0	111.7	Y284 H286 Y318 P396 K400 P409 R410	Y284-Y398 WeakPolarHBondContact O-CA 3.48Å; H286-Y398 AromaticContact ND1-CD1 3.78Å; Y318-Y398 HydrophobicContact CD1-CD1 4.37Å; Y318-Y398 AromaticContact CD1-CE1 3.55Å; Y318-Y398 HydrophobicContact CD1-CE1 3.55Å; Y318-Y398 AromaticContact CD1-CZ 3.76Å; Y318-Y398 HydrophobicContact CE1-CD1 4.06Å; Y318-Y398 AromaticContact CE1-CE1 3.7Å; Y318-Y398 HydrophobicContact CE1-CE1 3.7Å; P396-Y398 HydrophobicContact CB-CE2 3.9Å; P396-Y398 HydrophobicContact CG-CE2 3.94Å; Y398-K400 PolarHBondContact O-N 3.15Å; Y398-P409 HydrophobicContact CE1-CB 3.94Å; Y398-R410 HydrophobicContact CD2-CB 4.43Å; Y398-R410 HydrophobicContact CE2-CB 4.48Å; Y398-R410 HydrophobicContact CG-CB 4.46Å
399	N	87.1	Confident	72.2	Confident	20 Å²	20	76.2 Å²	76.2	11%	0.107	39%	0.387	C	S	.	.			trans	-58.9	131	169.3	-167.3	-20.5	0	0	0	110.1	Y284 D285 H286 D401 R402	Y284-N399 HydrophobicContact CD1-CB 3.78Å; Y284-N399 HydrophobicContact CE1-CB 3.41Å; Y284-N399 VanDerWaalsContact CE1-CB 3.41Å; Y284-N399 PolarHBondContact O-N 2.78Å; D285-N399 WeakPolarHBondContact OD1-CB 3.25Å; D285-N399 PolarHBondContact OD1-ND2 2.82Å; H286-N399 PolarHBondContact NE2-O 2.94Å; N399-D401 PolarHBondContact OD1-N 3.22Å; N399-R402 HydrophobicContact CB-CB 4.01Å; N399-R402 PolarHBondContact OD1-N 3.09Å
400	K	84.6	Confident	70.5	Confident	182 Å²	182	77.1 Å²	77.1	79%	0.791	39%	0.386	S	S	*	.	S	Bend	trans	-93.7	-25.2	179.2	-63.2	178.8	-176.5	174	0	112.8	Y398	Y398-K400 PolarHBondContact O-N 3.15Å
401	D	78.7	Confident	69	Low	140 Å²	140	74.7 Å²	74.7	75%	0.749	38%	0.38	S	S	*	.	S	Bend	trans	-87	-27.4	-176.6	-51.8	-52.5	0	0	0	111.2	N399	N399-D401 PolarHBondContact OD1-N 3.22Å
402	R	73.4	Confident	67.8	Low	37 Å²	37	76.6 Å²	76.6	14%	0.14	38%	0.381	C	S	.	.	S	Bend	trans	-78.1	128.5	167.2	174.2	170.9	-78.9	-91	4.6	110.8	L249 G252 Q253 D285 N399	L249-R402 PolarHBondContact O-NH2 2.76Å; G252-R402 VanDerWaalsContact C-NH2 3.28Å; G252-R402 PolarHBondContact O-NH2 2.61Å; Q253-R402 PolarHBondContact O-NH1 3.29Å; Q253-R402 VanDerWaalsContact O-NH1 3.17Å; Q253-R402 PolarHBondContact O-NH2 2.92Å; D285-R402 WeakPolarHBondContact O-CD 3.4Å; D285-R402 IonicContact OD1-NE 2.68Å; N399-R402 HydrophobicContact CB-CB 4.01Å; N399-R402 PolarHBondContact OD1-N 3.09Å
403	R	63.7	Low	66.2	Low	100 Å²	100	75.6 Å²	75.6	38%	0.377	37%	0.373	S	S	.	.	P	Polyproline II helix	trans	-57	125.3	168.7	-176.1	-163.8	179	-173.8	10.6	109.4	E97 T405	E97-R403 VanDerWaalsContact CD-NH2 3.29Å; E97-R403 IonicContact OE1-CZ 3.42Å; E97-R403 IonicContact OE1-NH1 2.69Å; E97-R403 PolarHBondContact OE1-NH1 2.8Å; E97-R403 IonicContact OE1-NH2 3.54Å; E97-R403 PolarHBondContact OE1-NH2 3.17Å; E97-R403 IonicContact OE2-CZ 3.19Å; E97-R403 IonicContact OE2-NH1 2.76Å; E97-R403 PolarHBondContact OE2-NH1 3.25Å; E97-R403 IonicContact OE2-NH2 3.57Å; R403-T405 PolarHBondContact O-N 3.38Å
404	P	58.9	Low	64.9	Low	45 Å²	45	71.4 Å²	71.4	29%	0.292	35%	0.35	S	S	.	.	P	Polyproline II helix	trans	-62.9	137.9	170.7	26.7	-33	0	0	0	109.6	R410	P404-R410 HydrophobicContact CB-CB 4.32Å
405	T	54.8	Low	63.5	Low	32 Å²	32	69.6 Å²	69.6	20%	0.196	35%	0.35	C	S	.	.	P	Polyproline II helix	trans	-63.8	147.1	171.8	41.7	0	0	0	0	110.2	N256 R403 H407 G408	N256-T405 WeakPolarHBondContact ND2-CG2 3.16Å; N256-T405 PolarHBondContact ND2-OG1 3.22Å; R403-T405 PolarHBondContact O-N 3.38Å; T405-H407 PolarHBondContact O-N 3.34Å; T405-G408 PolarHBondContact O-N 3.3Å; T405-G408 WeakPolarHBondContact OG1-CA 3.47Å; T405-G408 PolarHBondContact OG1-N 2.8Å
406	I	51.6	Low	61.8	Low	78 Å²	78	66.5 Å²	66.5	40%	0.4	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-23.7	-171.5	-62	173.5	0	0	0	112.1	L52 T94	L52-I406 HydrophobicContact CD2-CD1 4.49Å; T94-I406 HydrophobicContact CG2-CD1 3.78Å
407	H	49.3	Very low	59.7	Low	114 Å²	114	70.4 Å²	70.4	53%	0.528	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	-121.4	25.8	173.5	-50.6	-71.9	0	0	0	112.6	T405	T405-H407 PolarHBondContact O-N 3.34Å
408	G	49.5	Very low	57.3	Low	1 Å²	1	72.8 Å²	72.8	1%	0.01	36%	0.364	C	S	.	.	S	Bend	trans	-71.2	169	-177.8	0	0	0	0	0	114.2	T405 R410 A411 V412	T405-G408 PolarHBondContact O-N 3.3Å; T405-G408 WeakPolarHBondContact OG1-CA 3.47Å; T405-G408 PolarHBondContact OG1-N 2.8Å; G408-R410 PolarHBondContact O-N 3.12Å; G408-R410 VanDerWaalsContact O-N 3.15Å; G408-A411 WeakPolarHBondContact O-CA 3.13Å; G408-A411 WeakPolarHBondContact O-CB 3.45Å; G408-A411 PolarHBondContact O-N 3.35Å; G408-V412 PolarHBondContact O-N 2.67Å; G408-V412 VanDerWaalsContact O-N 3.1Å
409	P	44.7	Very low	54.9	Low	11 Å²	11	76.4 Å²	76.4	7%	0.071	39%	0.391	C	S	.	.	H	α-helix	trans	-54.1	-37.3	176.4	-21.5	29.7	0	0	0	112.4	H286 A287 Y398 V412 Y413	H286-P409 WeakPolarHBondContact O-CD 3.49Å; A287-P409 WeakPolarHBondContact O-CG 3.49Å; Y398-P409 HydrophobicContact CE1-CB 3.94Å; P409-V412 PolarHBondContact O-N 3.07Å; P409-Y413 VanDerWaalsContact O-CB 3.24Å; P409-Y413 WeakPolarHBondContact O-CB 3.44Å; P409-Y413 PolarHBondContact O-N 3.08Å
410	R	49.5	Very low	52.5	Low	84 Å²	84	84.4 Å²	84.4	32%	0.317	43%	0.427	S	S	.	.	H	α-helix	trans	-64.5	-38.6	174.5	179.7	170.6	173.3	-172.3	-1.2	113.1	H286 Y398 P404 G408 V412 Y413 D414	H286-R410 WeakPolarHBondContact ND1-CB 3.38Å; Y398-R410 HydrophobicContact CD2-CB 4.43Å; Y398-R410 HydrophobicContact CE2-CB 4.48Å; Y398-R410 HydrophobicContact CG-CB 4.46Å; P404-R410 HydrophobicContact CB-CB 4.32Å; G408-R410 PolarHBondContact O-N 3.12Å; G408-R410 VanDerWaalsContact O-N 3.15Å; R410-V412 VanDerWaalsContact C-N 3.32Å; R410-V412 PolarHBondContact O-N 3.2Å; R410-Y413 PolarHBondContact O-N 3.42Å; R410-D414 VanDerWaalsContact CG-OD2 3.3Å; R410-D414 WeakPolarHBondContact CG-OD2 3.46Å; R410-D414 IonicContact NE-OD2 2.93Å; R410-D414 PolarHBondContact NE-OD2 2.78Å; R410-D414 VanDerWaalsContact O-CB 3.23Å; R410-D414 WeakPolarHBondContact O-CB 3.32Å; R410-D414 VanDerWaalsContact O-CG 3.24Å; R410-D414 PolarHBondContact O-N 3.37Å
411	A	50.2	Low	49.8	Very low	28 Å²	28	86.3 Å²	86.3	23%	0.231	43%	0.431	C	S	.	.	H	α-helix	trans	-65.9	-37.5	175.9	0	0	0	0	0	111.2	G408 S415	G408-A411 WeakPolarHBondContact O-CA 3.13Å; G408-A411 WeakPolarHBondContact O-CB 3.45Å; G408-A411 PolarHBondContact O-N 3.35Å; A411-S415 VanDerWaalsContact O-CB 3.25Å; A411-S415 WeakPolarHBondContact O-CB 3.43Å; A411-S415 PolarHBondContact O-N 3.5Å; A411-S415 PolarHBondContact O-OG 3.18Å
412	V	50.9	Low	47.4	Very low	87 Å²	87	85.9 Å²	85.9	53%	0.527	43%	0.429	S	S	.	.	H	α-helix	trans	-66.7	-49.5	172.7	-179.4	0	0	0	0	111.1	G408 P409 R410 S415 V416	G408-V412 PolarHBondContact O-N 2.67Å; G408-V412 VanDerWaalsContact O-N 3.1Å; P409-V412 PolarHBondContact O-N 3.07Å; R410-V412 VanDerWaalsContact C-N 3.32Å; R410-V412 PolarHBondContact O-N 3.2Å; V412-S415 WeakPolarHBondContact O-CB 3.46Å; V412-S415 PolarHBondContact O-N 3.31Å; V412-V416 HydrophobicContact CG1-CG2 4.4Å; V412-V416 VanDerWaalsContact O-CG2 3.32Å; V412-V416 WeakPolarHBondContact O-CG2 3.49Å; V412-V416 PolarHBondContact O-N 3.15Å
413	Y	48.5	Very low	45.2	Very low	63 Å²	63	90 Å²	90	25%	0.247	45%	0.454	C	S	.	.	H	α-helix	trans	-59.3	-50	178.8	-176.9	-81.7	0	0	0	111.7	P396 P409 R410 S415 V416 H417	P396-Y413 HydrophobicContact CG-CD2 4Å; P396-Y413 HydrophobicContact CG-CE2 3.71Å; P409-Y413 VanDerWaalsContact O-CB 3.24Å; P409-Y413 WeakPolarHBondContact O-CB 3.44Å; P409-Y413 PolarHBondContact O-N 3.08Å; R410-Y413 PolarHBondContact O-N 3.42Å; Y413-S415 VanDerWaalsContact C-N 3.28Å; Y413-S415 PolarHBondContact O-N 2.8Å; Y413-V416 PolarHBondContact O-N 3.41Å; Y413-V416 VanDerWaalsContact O-N 3.16Å; Y413-H417 AromaticContact CD1-CD2 3.9Å; Y413-H417 AromaticContact CD2-CD2 3.46Å; Y413-H417 VanDerWaalsContact CD2-CD2 3.46Å; Y413-H417 WeakPolarHBondContact CD2-CD2 3.35Å; Y413-H417 AromaticContact CD2-NE2 3.8Å; Y413-H417 HydrophobicContact CE1-CB 4.26Å; Y413-H417 AromaticContact CE1-CD2 3.84Å; Y413-H417 AromaticContact CE2-CD2 3.42Å; Y413-H417 VanDerWaalsContact CE2-CD2 3.42Å; Y413-H417 WeakPolarHBondContact CE2-CD2 3.4Å; Y413-H417 AromaticContact CE2-NE2 3.63Å; Y413-H417 AromaticContact CG-CD2 3.7Å; Y413-H417 AromaticContact CZ-CD2 3.6Å; Y413-H417 WeakPolarHBondContact O-CB 3.42Å; Y413-H417 PolarHBondContact O-CD2 2.86Å; Y413-H417 VanDerWaalsContact O-CD2 3.27Å; Y413-H417 PolarHBondContact O-N 2.89Å
414	D	49	Very low	43.6	Very low	57 Å²	57	91.6 Å²	91.6	31%	0.305	47%	0.47	S	S	.	.	H	α-helix	trans	-62.9	-36	177.9	-69.4	-19.1	0	0	0	110.4	R410 F418	R410-D414 VanDerWaalsContact CG-OD2 3.3Å; R410-D414 WeakPolarHBondContact CG-OD2 3.46Å; R410-D414 IonicContact NE-OD2 2.93Å; R410-D414 PolarHBondContact NE-OD2 2.78Å; R410-D414 VanDerWaalsContact O-CB 3.23Å; R410-D414 WeakPolarHBondContact O-CB 3.32Å; R410-D414 VanDerWaalsContact O-CG 3.24Å; R410-D414 PolarHBondContact O-N 3.37Å; D414-F418 CarbonylContact O-C 3.5Å; D414-F418 WeakPolarHBondContact O-CA 3.43Å; D414-F418 WeakPolarHBondContact O-CB 3.33Å; D414-F418 PolarHBondContact O-N 2.91Å
415	S	49.9	Very low	42.2	Very low	81 Å²	81	95.5 Å²	95.5	57%	0.566	49%	0.488	S	S	*	.	H	α-helix	trans	-69.9	-30.5	174.4	-60.5	0	0	0	0	114.5	A411 V412 Y413	A411-S415 VanDerWaalsContact O-CB 3.25Å; A411-S415 WeakPolarHBondContact O-CB 3.43Å; A411-S415 PolarHBondContact O-N 3.5Å; A411-S415 PolarHBondContact O-OG 3.18Å; V412-S415 WeakPolarHBondContact O-CB 3.46Å; V412-S415 PolarHBondContact O-N 3.31Å; Y413-S415 VanDerWaalsContact C-N 3.28Å; Y413-S415 PolarHBondContact O-N 2.8Å
416	V	45.1	Very low	41.2	Very low	96 Å²	96	101.7 Å²	101.7	58%	0.582	52%	0.52	S	S	*	.	H	α-helix	trans	-85.4	-35.6	-179.9	170	0	0	0	0	111.7	V412 Y413	V412-V416 HydrophobicContact CG1-CG2 4.4Å; V412-V416 VanDerWaalsContact O-CG2 3.32Å; V412-V416 WeakPolarHBondContact O-CG2 3.49Å; V412-V416 PolarHBondContact O-N 3.15Å; Y413-V416 PolarHBondContact O-N 3.41Å; Y413-V416 VanDerWaalsContact O-N 3.16Å
417	H	41.2	Very low	40.3	Very low	103 Å²	103	104.6 Å²	104.6	48%	0.477	54%	0.536	S	S	.	.	H	α-helix	trans	-103.5	-17.7	-173.2	-64.4	-68.8	0	0	0	114.8	Y413	Y413-H417 AromaticContact CD1-CD2 3.9Å; Y413-H417 AromaticContact CD2-CD2 3.46Å; Y413-H417 VanDerWaalsContact CD2-CD2 3.46Å; Y413-H417 WeakPolarHBondContact CD2-CD2 3.35Å; Y413-H417 AromaticContact CD2-NE2 3.8Å; Y413-H417 HydrophobicContact CE1-CB 4.26Å; Y413-H417 AromaticContact CE1-CD2 3.84Å; Y413-H417 AromaticContact CE2-CD2 3.42Å; Y413-H417 VanDerWaalsContact CE2-CD2 3.42Å; Y413-H417 WeakPolarHBondContact CE2-CD2 3.4Å; Y413-H417 AromaticContact CE2-NE2 3.63Å; Y413-H417 AromaticContact CG-CD2 3.7Å; Y413-H417 AromaticContact CZ-CD2 3.6Å; Y413-H417 WeakPolarHBondContact O-CB 3.42Å; Y413-H417 PolarHBondContact O-CD2 2.86Å; Y413-H417 VanDerWaalsContact O-CD2 3.27Å; Y413-H417 PolarHBondContact O-N 2.89Å
418	F	36.5	Very low	39.6	Very low	144 Å²	144	107.1 Å²	107.1	63%	0.632	55%	0.554	S	S	*	*			trans	-131	72.6	176.8	-64.6	-76.9	0	0	0	113	D414 Q420	D414-F418 CarbonylContact O-C 3.5Å; D414-F418 WeakPolarHBondContact O-CA 3.43Å; D414-F418 WeakPolarHBondContact O-CB 3.33Å; D414-F418 PolarHBondContact O-N 2.91Å; F418-Q420 PolarHBondContact O-N 3.13Å
419	P	36.4	Very low	38.6	Very low	101 Å²	101	110 Å²	110	66%	0.656	58%	0.583	S	S	*	*			trans	-56.1	123.4	166.9	-20.2	32.4	0	0	0	110.1	Y421	P419-Y421 PolarHBondContact O-N 3.45Å; P419-Y421 VanDerWaalsContact O-N 3.13Å
420	Q	35.5	Very low	38	Very low	188 Å²	188	116.3 Å²	116.3	88%	0.879	62%	0.616	S	S	*	*			trans	-65.7	115.5	-176.8	-68.2	-175.7	-0	0	0	110.7	F418 N422	F418-Q420 PolarHBondContact O-N 3.13Å; Q420-N422 PolarHBondContact O-N 2.94Å
421	Y	27.9	Very low	37.2	Very low	223 Å²	223	118.4 Å²	118.4	88%	0.875	63%	0.634	S	S	*	*			trans	-68.7	91.4	172.6	-121.2	-92.8	0	0	0	109.1	P419 N423	P419-Y421 PolarHBondContact O-N 3.45Å; P419-Y421 VanDerWaalsContact O-N 3.13Å; Y421-N423 VanDerWaalsContact C-N 3.28Å; Y421-N423 PolarHBondContact O-N 3.44Å
422	N	28.4	Very low	36.3	Very low	131 Å²	131	123.3 Å²	123.3	70%	0.701	66%	0.656	S	S	*	*			trans	-74.9	76.8	-173.1	-168.4	6.7	0	0	0	111.7	Q420 N424	Q420-N422 PolarHBondContact O-N 2.94Å; N422-N424 VanDerWaalsContact C-N 3.26Å; N422-N424 PolarHBondContact O-N 3.36Å
423	N	28	Very low	35.4	Very low	124 Å²	124	124.9 Å²	124.9	66%	0.663	66%	0.662	S	S	*	*			trans	-84.4	58.6	-167.5	-158.1	6.3	0	0	0	112.6	Y421 N425	Y421-N423 VanDerWaalsContact C-N 3.28Å; Y421-N423 PolarHBondContact O-N 3.44Å; N423-N425 PolarHBondContact O-N 3.13Å
424	N	31.1	Very low	34.5	Very low	133 Å²	133	128.4 Å²	128.4	71%	0.711	69%	0.685	S	S	*	*			trans	-74.5	63.7	-179.4	-90.4	-17.9	0	0	0	113.2	N422 N426	N422-N424 VanDerWaalsContact C-N 3.26Å; N422-N424 PolarHBondContact O-N 3.36Å; N424-N426 PolarHBondContact O-N 3.3Å
425	N	29.1	Very low	33.9	Very low	127 Å²	127	131 Å²	131	68%	0.679	71%	0.707	S	S	*	*			trans	-93.5	68.8	172.3	-100.5	-38.7	0	0	0	111.6	N423 N427	N423-N425 PolarHBondContact O-N 3.13Å; N425-N427 PolarHBondContact O-N 3.04Å
426	N	33.7	Very low	32.9	Very low	162 Å²	162	134.7 Å²	134.7	87%	0.866	72%	0.721	S	S	*	*			trans	-90.1	95.9	167.8	-93.5	-15.7	0	0	0	110.4	N424	N424-N426 PolarHBondContact O-N 3.3Å
427	N	31.6	Very low	32.4	Very low	138 Å²	138	135.1 Å²	135.1	74%	0.738	73%	0.726	S	S	*	*			trans	-69.2	141.2	169.4	-73.9	-61.4	0	0	0	111.3	N425	N425-N427 PolarHBondContact O-N 3.04Å
428	N	34.5	Very low	31.9	Very low	168 Å²	168	137.1 Å²	137.1	90%	0.898	75%	0.745	S	S	*	*				-166.8	126.1	127.5	-105.7	-27.9	0	0	0	114.8
429	G	29.1	Very low	31.6	Very low	61 Å²	61	135 Å²	135	63%	0.629	75%	0.749	S	S	*	*			trans	63	96.9	141	0	0	0	0	0	120.2
430	N	33	Very low	31.3	Very low	143 Å²	143	136 Å²	136	77%	0.765	75%	0.753	S	S	*	*				-175.4	141.4	90.5	-93.7	-40.2	0	0	0	113.7
431	N	31	Very low	31	Very low	128 Å²	128	138.9 Å²	138.9	68%	0.684	76%	0.756	S	S	*	*			trans	34.5	125.8	134.3	-51.8	-17.1	0	0	0	118
432	N	32.3	Very low	31.1	Very low	132 Å²	132	138 Å²	138	71%	0.706	76%	0.756	S	S	*	*			cis	-170.9	163.9	41.3	-119.4	-11	0	0	0	114.7
433	N	32	Very low	31.4	Very low	119 Å²	119	137.7 Å²	137.7	64%	0.636	76%	0.761	S	S	*	*			trans	68.9	105	146.6	-63.1	-9.3	0	0	0	122.5
434	N	30.4	Very low	31.4	Very low	138 Å²	138	137.1 Å²	137.1	74%	0.738	77%	0.767	S	S	*	*				104.3	122.2	120.1	-67.4	-10.5	0	0	0	122.3
435	S	34.9	Very low	31.2	Very low	110 Å²	110	140.8 Å²	140.8	77%	0.769	78%	0.777	S	S	*	*			trans	71	139.3	150.3	72.7	0	0	0	0	119.5
436	N	29.6	Very low	31.1	Very low	159 Å²	159	139.2 Å²	139.2	85%	0.85	78%	0.782	S	S	*	*			cis	-154.1	157.7	-32.8	-129.2	8.7	0	0	0	109.5
437	P	35.4	Very low	30.8	Very low	106 Å²	106	139.9 Å²	139.9	69%	0.688	78%	0.782	S	S	*	*			trans	-106.3	158.3	-160.3	39.1	-36	0	0	0	116.7
438	T	29.8	Very low	30.4	Very low	144 Å²	144	138.9 Å²	138.9	88%	0.883	79%	0.786	S	S	*	*			trans	-164.4	150.1	146.6	15.8	0	0	0	0	108.3
439	S	30.8	Very low	30.1	Very low	101 Å²	101	136.1 Å²	136.1	71%	0.706	78%	0.775	S	S	*	*			cis	-144.3	156	-3.5	-174.5	0	0	0	0	112
440	T	28.6	Very low	29.8	Very low	122 Å²	122	140.6 Å²	140.6	75%	0.748	78%	0.784	S	S	*	*			trans	-32.1	153.3	172.1	66.5	0	0	0	0	117.2
441	R	31	Very low	29.6	Very low	248 Å²	248	144.6 Å²	144.6	94%	0.936	79%	0.788	S	S	*	*				-146.5	161.5	55.3	-112.1	173.7	173.3	169.6	-1.9	115.2
442	K	29.8	Very low	29.5	Very low	204 Å²	204	146.7 Å²	146.7	89%	0.887	79%	0.794	S	S	*	*			trans	-106.7	169	-167.6	-98.8	-169.4	173.4	-178.3	0	114.3
443	P	34	Very low	29.3	Very low	124 Å²	124	147.9 Å²	147.9	81%	0.805	80%	0.8	S	S	*	*			trans	-108.1	-173.8	-155.9	43	-39.1	0	0	0	115.3
444	S	27.8	Very low	28.9	Very low	113 Å²	113	147.7 Å²	147.7	79%	0.79	81%	0.805	S	S	*	*			trans	-143.1	109.6	168.2	62.3	0	0	0	0	115.5
445	K	27.6	Very low	28.7	Very low	209 Å²	209	146.4 Å²	146.4	91%	0.909	80%	0.804	S	S	*	*			trans	65.3	88.5	131.4	-151	173.4	-168.7	176.4	0	119.9
446	A	26.5	Very low	28.3	Very low	95 Å²	95	145.7 Å²	145.7	79%	0.785	80%	0.796	S	S	*	*			trans	-136	108.7	147.6	0	0	0	0	0	107.2
447	M	26.4	Very low	28.1	Very low	175 Å²	175	144.1 Å²	144.1	86%	0.862	79%	0.794	S	S	*	*				65.9	103.5	99.5	-73.7	-164.3	70.5	0	0	114.2
448	S	24.5	Very low	27.8	Very low	118 Å²	118	148.3 Å²	148.3	83%	0.825	80%	0.797	S	S	*	*			trans	-61.9	131.2	170.3	-39	0	0	0	0	110.9
449	V	27.8	Very low	27.6	Very low	110 Å²	110	150.1 Å²	150.1	67%	0.667	80%	0.796	S	S	*	*			trans	-142.4	112.8	160.9	-176.1	0	0	0	0	107	R451	V449-R451 HydrophobicContact CG1-CG 4.28Å; V449-R451 PolarHBondContact O-N 3.31Å; V449-R451 VanDerWaalsContact O-N 3.16Å
450	D	23.6	Very low	27.1	Very low	155 Å²	155	156.7 Å²	156.7	83%	0.829	81%	0.805	S	S	*	*			trans	-61.7	116.1	167.2	-58.3	-78.6	0	0	0	108.5
451	R	28.4	Very low	26.9	Very low	226 Å²	226	155.9 Å²	155.9	85%	0.853	80%	0.803	S	S	*	*			trans	-113.4	89.6	167.5	-82.5	-168.9	167.3	-170.6	-3.7	108.4	V449 L453	V449-R451 HydrophobicContact CG1-CG 4.28Å; V449-R451 PolarHBondContact O-N 3.31Å; V449-R451 VanDerWaalsContact O-N 3.16Å; R451-L453 PolarHBondContact O-N 3.32Å
452	E	27.4	Very low	26.6	Very low	173 Å²	173	150.9 Å²	150.9	81%	0.808	79%	0.794	S	S	*	*			trans	-43.3	137	155.8	-58.3	-178.3	127.1	0	0	109
453	L	28.2	Very low	26.4	Very low	156 Å²	156	145.7 Å²	145.7	82%	0.817	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-60.7	129.8	157.5	-74.6	82.2	0	0	0	106	R451 P455	R451-L453 PolarHBondContact O-N 3.32Å; L453-P455 WeakPolarHBondContact O-CD 3.45Å; L453-P455 VanDerWaalsContact O-N 3.14Å
454	P	24.8	Very low	26.1	Very low	115 Å²	115	147.5 Å²	147.5	75%	0.747	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-58	125.4	171.8	25.1	-32.4	0	0	0	107.4
455	P	26.1	Very low	26.4	Very low	111 Å²	111	144 Å²	144	72%	0.721	75%	0.751	S	S	*	*	P	Polyproline II helix	trans	-58	149.6	174.7	25.5	-33.8	0	0	0	108.7	L453	L453-P455 WeakPolarHBondContact O-CD 3.45Å; L453-P455 VanDerWaalsContact O-N 3.14Å
456	T	26.8	Very low	26.8	Very low	96 Å²	96	137.6 Å²	137.6	59%	0.589	73%	0.726	S	S	*	*			trans	-44.7	131.2	-175.8	48.5	0	0	0	0	112.1	Y458	T456-Y458 HydrophobicContact CG2-CD2 4.29Å; T456-Y458 PolarHBondContact O-N 3.19Å
457	P	24.7	Very low	27.4	Very low	125 Å²	125	135.5 Å²	135.5	81%	0.812	70%	0.701	S	S	*	*	S	Bend	trans	-73.5	37.3	176	30.7	-35.2	0	0	0	112.9	Q459	P457-Q459 PolarHBondContact O-N 2.94Å
458	Y	29	Very low	27.7	Very low	194 Å²	194	131.6 Å²	131.6	76%	0.761	68%	0.684	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.4	8.1	173.5	-92.1	-62.5	0	0	0	113.5	T456	T456-Y458 HydrophobicContact CG2-CD2 4.29Å; T456-Y458 PolarHBondContact O-N 3.19Å
459	Q	25.4	Very low	28	Very low	183 Å²	183	129 Å²	129	86%	0.855	66%	0.66	S	S	*	*	T	Hydrogen-bonded Turn	trans	-127.1	9.1	-174.6	-70.4	-172	-28.2	0	0	115.3	P457	P457-Q459 PolarHBondContact O-N 2.94Å
460	R	21.4	Very low	28.5	Very low	238 Å²	238	129.3 Å²	129.3	90%	0.898	65%	0.65	S	S	*	*			trans	-138.1	58.6	176.5	-81.6	-167.6	175.3	151.1	0.1	114.9
461	C	23.6	Very low	28.9	Very low	106 Å²	106	130 Å²	130	72%	0.716	65%	0.648	S	S	*	*	S	Bend	trans	-112.9	134.8	142.4	-64.4	0	0	0	0	106.6	S463	C461-S463 PolarHBondContact O-N 2.81Å
462	L	24.1	Very low	29	Very low	143 Å²	143	123.3 Å²	123.3	75%	0.749	63%	0.628	S	S	*	*			trans	-59.8	135.9	-174.5	-73.8	168.1	0	0	0	110.9	F464	L462-F464 VanDerWaalsContact C-N 3.28Å; L462-F464 HydrophobicContact CB-CD2 4.31Å; L462-F464 HydrophobicContact CB-CE2 4.06Å; L462-F464 HydrophobicContact CB-CZ 4.46Å; L462-F464 HydrophobicContact CD1-CZ 4.46Å; L462-F464 PolarHBondContact O-N 3.05Å
463	S	26.2	Very low	29.2	Very low	95 Å²	95	119.9 Å²	119.9	66%	0.664	62%	0.619	S	S	*	*			trans	-69.8	90.4	164.8	52.8	0	0	0	0	108.6	C461 D465	C461-S463 PolarHBondContact O-N 2.81Å; S463-D465 PolarHBondContact O-N 3.36Å
464	F	28.5	Very low	29.4	Very low	162 Å²	162	118 Å²	118	71%	0.711	62%	0.617	S	S	*	*			trans	-68	77.1	163.1	-71.4	-79	0	0	0	108.8	L462 M466	L462-F464 VanDerWaalsContact C-N 3.28Å; L462-F464 HydrophobicContact CB-CD2 4.31Å; L462-F464 HydrophobicContact CB-CE2 4.06Å; L462-F464 HydrophobicContact CB-CZ 4.46Å; L462-F464 HydrophobicContact CD1-CZ 4.46Å; L462-F464 PolarHBondContact O-N 3.05Å; F464-M466 PolarHBondContact O-N 2.97Å
465	D	32.9	Very low	29.7	Very low	38 Å²	38	122 Å²	122	20%	0.203	62%	0.622	C	S	.	*			trans	-71.5	112.8	164.3	-151.9	-57.2	0	0	0	106.6	K87 S463 N467 D468	K87-D465 WeakPolarHBondContact CD-OD2 3.38Å; K87-D465 IonicContact NZ-OD2 3.78Å; K87-D465 PolarHBondContact NZ-OD2 3.04Å; S463-D465 PolarHBondContact O-N 3.36Å; D465-N467 PolarHBondContact O-N 3.33Å; D465-N467 WeakPolarHBondContact OD1-CB 3.37Å; D465-N467 PolarHBondContact OD1-N 2.91Å; D465-N467 PolarHBondContact OD1-ND2 3.15Å; D465-D468 PolarHBondContact O-N 2.86Å
466	M	36.4	Very low	30	Very low	75 Å²	75	124.5 Å²	124.5	37%	0.369	62%	0.617	S	S	.	*	T	Hydrogen-bonded Turn	trans	-64	-2.6	-177.6	-58.5	-62.5	-82.1	0	0	112.6	V216 F464 L469	V216-M466 HydrophobicContact CG1-CE 3.24Å; F464-M466 PolarHBondContact O-N 2.97Å; M466-L469 HydrophobicContact CE-CD1 4.48Å; M466-L469 HydrophobicContact SD-CD1 4.27Å
467	N	38.7	Very low	30.3	Very low	51 Å²	51	124 Å²	124	27%	0.273	61%	0.61	S	S	.	*	T	Hydrogen-bonded Turn	trans	-91.5	-22.1	171.3	-54.3	-71.2	0	0	0	113.6	D465 L469 R470	D465-N467 PolarHBondContact O-N 3.33Å; D465-N467 WeakPolarHBondContact OD1-CB 3.37Å; D465-N467 PolarHBondContact OD1-N 2.91Å; D465-N467 PolarHBondContact OD1-ND2 3.15Å; N467-L469 VanDerWaalsContact C-N 3.31Å; N467-R470 VanDerWaalsContact O-CB 3.3Å; N467-R470 WeakPolarHBondContact O-CB 3.35Å; N467-R470 WeakPolarHBondContact O-CG 3.41Å; N467-R470 PolarHBondContact O-N 2.97Å; N467-R470 VanDerWaalsContact O-N 3.15Å; N467-R470 PolarHBondContact OD1-NE 3.16Å; N467-R470 PolarHBondContact OD1-NH2 3.29Å
468	D	33.6	Very low	30.7	Very low	93 Å²	93	124.6 Å²	124.6	50%	0.497	61%	0.606	S	S	.	*	G	3₁₀ helix	trans	-71.4	-28.6	176.5	-73.3	-24.8	0	0	0	111.7	D465 R470 Q471	D465-D468 PolarHBondContact O-N 2.86Å; D468-R470 PolarHBondContact O-N 3.07Å; D468-Q471 PolarHBondContact O-N 3.08Å
469	L	31.3	Very low	30.9	Very low	63 Å²	63	122.3 Å²	122.3	33%	0.33	60%	0.603	S	S	.	*	G	3₁₀ helix	trans	-57.6	-25.6	169.2	-80.5	165.8	0	0	0	113	M466 N467 Q471 I472	M466-L469 HydrophobicContact CE-CD1 4.48Å; M466-L469 HydrophobicContact SD-CD1 4.27Å; N467-L469 VanDerWaalsContact C-N 3.31Å; L469-Q471 PolarHBondContact O-N 3.48Å; L469-Q471 VanDerWaalsContact O-N 3.11Å; L469-I472 PolarHBondContact O-N 2.98Å
470	R	37.2	Very low	31.1	Very low	117 Å²	117	123.4 Å²	123.4	44%	0.442	60%	0.6	S	S	.	*	G	3₁₀ helix	trans	-70.8	-4.1	-178.9	-54.4	-172.7	-164	-158.7	16.9	114.4	F140 N467 D468	F140-R470 PolarHBondContact O-NH1 2.84Å; F140-R470 PolarHBondContact O-NH2 3.39Å; N467-R470 VanDerWaalsContact O-CB 3.3Å; N467-R470 WeakPolarHBondContact O-CB 3.35Å; N467-R470 WeakPolarHBondContact O-CG 3.41Å; N467-R470 PolarHBondContact O-N 2.97Å; N467-R470 VanDerWaalsContact O-N 3.15Å; N467-R470 PolarHBondContact OD1-NE 3.16Å; N467-R470 PolarHBondContact OD1-NH2 3.29Å; D468-R470 PolarHBondContact O-N 3.07Å
471	Q	33	Very low	31.5	Very low	170 Å²	170	117.4 Å²	117.4	79%	0.794	59%	0.59	S	S	*	*	G	3₁₀ helix	trans	-112.2	2	175.7	-66.3	-173.9	84.2	0	0	113.3	D468 L469	D468-Q471 PolarHBondContact O-N 3.08Å; L469-Q471 PolarHBondContact O-N 3.48Å; L469-Q471 VanDerWaalsContact O-N 3.11Å
472	I	30.6	Very low	31.7	Very low	86 Å²	86	120.7 Å²	120.7	44%	0.441	59%	0.592	S	S	.	*			trans	-101.8	108.3	-175.7	-57.2	179.7	0	0	0	109.6	L469 R476	L469-I472 PolarHBondContact O-N 2.98Å; I472-R476 HydrophobicContact CG2-CB 4.13Å
473	T	30.1	Very low	31.8	Very low	101 Å²	101	122.3 Å²	122.3	62%	0.62	60%	0.596	S	S	*	*			trans	-62.9	148.4	174	54.3	0	0	0	0	111.2	K475 R476	T473-K475 PolarHBondContact O-N 3.18Å; T473-R476 PolarHBondContact O-N 2.93Å
474	P	32.4	Very low	31.8	Very low	117 Å²	117	125.3 Å²	125.3	76%	0.76	61%	0.605	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.1	6.2	-166.9	24	-35	0	0	0	116.1
475	K	32.7	Very low	31.8	Very low	197 Å²	197	125.8 Å²	125.8	86%	0.857	61%	0.606	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.4	-1.5	178.4	-67.2	-174.6	175.8	-179.8	0	114.7	T473	T473-K475 PolarHBondContact O-N 3.18Å
476	R	31.5	Very low	31.6	Very low	165 Å²	165	129.4 Å²	129.4	62%	0.623	63%	0.629	S	S	*	*	S	Bend	trans	-113.3	-11.3	-178.2	-99.3	-177.1	169.7	175.1	-1.7	116.9	I472 T473 N478 Q479	I472-R476 HydrophobicContact CG2-CB 4.13Å; T473-R476 PolarHBondContact O-N 2.93Å; R476-N478 PolarHBondContact O-N 3.31Å; R476-Q479 PolarHBondContact O-N 3.13Å
477	I	33.7	Very low	31.2	Very low	84 Å²	84	130.9 Å²	130.9	43%	0.431	64%	0.639	S	S	.	*	G	3₁₀ helix	trans	-66	-36.9	-176.1	-65.7	174.4	0	0	0	111.7	Q479	I477-Q479 PolarHBondContact O-N 3.41Å
478	N	32.4	Very low	30.7	Very low	139 Å²	139	137.9 Å²	137.9	74%	0.743	67%	0.667	S	S	*	*	G	3₁₀ helix	trans	-68.1	-0.1	179.2	-68.4	-7.7	0	0	0	115.1	R476	R476-N478 PolarHBondContact O-N 3.31Å
479	Q	34.2	Very low	30.4	Very low	146 Å²	146	143.9 Å²	143.9	68%	0.682	68%	0.683	S	S	*	*	G	3₁₀ helix	trans	-105.5	-3.2	-175	-147.4	167.8	24.5	0	0	114.4	R476 I477	R476-Q479 PolarHBondContact O-N 3.13Å; I477-Q479 PolarHBondContact O-N 3.41Å
480	Y	28.9	Very low	30.3	Very low	205 Å²	205	147.4 Å²	147.4	80%	0.804	71%	0.707	S	S	*	*	S	Bend	trans	-119.3	7.8	-179.7	-75.7	-81.4	0	0	0	114.6
481	V	29.8	Very low	29.9	Very low	112 Å²	112	147.6 Å²	147.6	68%	0.679	72%	0.724	S	S	*	*	S	Bend	trans	-128.2	58.2	-179	-165.1	0	0	0	0	111.1
482	F	27.1	Very low	29.9	Very low	175 Å²	175	147.1 Å²	147.1	77%	0.768	73%	0.726	S	S	*	*			trans	-147.3	146.9	170.6	-87.8	-74.8	0	0	0	111.9
483	H	26.9	Very low	30	Very low	177 Å²	177	150.4 Å²	150.4	82%	0.819	74%	0.743	S	S	*	*			trans	82.5	71.8	-178.1	-56	84.9	0	0	0	117.3
484	N	26.9	Very low	29.9	Very low	159 Å²	159	149.4 Å²	149.4	85%	0.85	75%	0.745	S	S	*	*			trans	-153.9	69.9	133.4	-103.5	-24.1	0	0	0	110.9	V486	N484-V486 PolarHBondContact O-N 3.35Å
485	K	27.1	Very low	29.9	Very low	171 Å²	171	155.3 Å²	155.3	74%	0.743	75%	0.752	S	S	*	*			trans	-70.8	113.3	162.7	-89.2	-167.3	164.3	-154.6	0	108.8	D487	K485-D487 VanDerWaalsContact C-N 3.34Å; K485-D487 WeakPolarHBondContact CD-OD2 3.33Å; K485-D487 PolarHBondContact O-N 2.91Å
486	V	29.4	Very low	29.7	Very low	114 Å²	114	157 Å²	157	69%	0.691	75%	0.753	S	S	*	*			trans	-92.2	74.3	166.1	-173.3	0	0	0	0	108	N484 F488	N484-V486 PolarHBondContact O-N 3.35Å; V486-F488 HydrophobicContact CG1-CD2 4.01Å; V486-F488 HydrophobicContact CG1-CE2 3.95Å; V486-F488 PolarHBondContact O-N 3.43Å
487	D	27.3	Very low	29.8	Very low	106 Å²	106	156.6 Å²	156.6	57%	0.567	76%	0.764	S	S	*	*			trans	-69.2	94.4	175.2	-76.9	-48.5	0	0	0	109.6	K485 R489	K485-D487 VanDerWaalsContact C-N 3.34Å; K485-D487 WeakPolarHBondContact CD-OD2 3.33Å; K485-D487 PolarHBondContact O-N 2.91Å; D487-R489 PolarHBondContact O-N 3.03Å
488	F	28	Very low	29.6	Very low	198 Å²	198	157.8 Å²	157.8	87%	0.868	78%	0.78	S	S	*	*			trans	-68.1	94.4	165.2	-92.3	-87.3	0	0	0	109.4	V486	V486-F488 HydrophobicContact CG1-CD2 4.01Å; V486-F488 HydrophobicContact CG1-CE2 3.95Å; V486-F488 PolarHBondContact O-N 3.43Å
489	R	27.7	Very low	29.7	Very low	220 Å²	220	157 Å²	157	83%	0.83	78%	0.779	S	S	*	*			trans	-124.8	126.4	167.1	-71.1	-170	173.9	-148.8	-4.7	110.4	D487	D487-R489 PolarHBondContact O-N 3.03Å
490	T	29.5	Very low	29.6	Very low	136 Å²	136	155.7 Å²	155.7	83%	0.834	78%	0.777	S	S	*	*			trans	-64.3	145	169.6	40.5	0	0	0	0	110.6
491	P	28.7	Very low	29.8	Very low	122 Å²	122	154 Å²	154	79%	0.792	77%	0.774	S	S	*	*			trans	-80.7	136.4	179.7	32.5	-33.2	0	0	0	111
492	D	32.8	Very low	29.9	Very low	159 Å²	159	155.9 Å²	155.9	85%	0.85	77%	0.773	S	S	*	*			trans	-146.4	160.5	158.5	-136.9	-33.7	0	0	0	112.4
493	I	32.2	Very low	29.9	Very low	155 Å²	155	155.2 Å²	155.2	80%	0.795	77%	0.772	S	S	*	*			trans	-106.2	108.6	-144.6	-62.5	174.5	0	0	0	114.5
494	A	29.7	Very low	30.1	Very low	80 Å²	80	149.9 Å²	149.9	66%	0.661	77%	0.765	S	S	*	*			trans	31.5	113	144.5	0	0	0	0	0	121.5
495	R	31.9	Very low	30.2	Very low	242 Å²	242	148.7 Å²	148.7	91%	0.913	76%	0.764	S	S	*	*				-171.4	110.4	128.1	-91.6	138.5	-168.8	-154.1	4.5	107.7
496	R	27.3	Very low	30.3	Very low	231 Å²	231	148.2 Å²	148.2	87%	0.872	77%	0.766	S	S	*	*				67.9	134.4	76.3	-83.5	-163.9	179.9	177	2.1	114.9
497	N	33.7	Very low	30.3	Very low	158 Å²	158	148.7 Å²	148.7	85%	0.845	77%	0.765	S	S	*	*			trans	78.7	133.3	176.4	-50.2	-8.7	0	0	0	114.2
498	S	30.6	Very low	30.6	Very low	109 Å²	109	149.7 Å²	149.7	76%	0.762	77%	0.77	S	S	*	*			cis	149	155.9	-26.3	-178.3	0	0	0	0	108.4
499	V	34.2	Very low	30.7	Very low	122 Å²	122	145.8 Å²	145.8	74%	0.739	76%	0.759	S	S	*	*			trans	84.1	91.6	169.7	-167.2	0	0	0	0	117.2
500	D	31.8	Very low	30.9	Very low	119 Å²	119	141.3 Å²	141.3	64%	0.636	75%	0.751	S	S	*	*				59.1	132.3	125.4	-74.4	21.3	0	0	0	125.5
501	K	33.3	Very low	31	Very low	169 Å²	169	140.7 Å²	140.7	74%	0.735	74%	0.742	S	S	*	*				95	111.4	129.8	-80.2	170.2	-176.3	114.1	0	122.2
502	K	32.1	Very low	31.2	Very low	151 Å²	151	141 Å²	141	66%	0.657	74%	0.738	S	S	*	*				74.5	118.9	128	-81.6	-175.3	163.3	-76.6	0	120.9
503	E	27.1	Very low	31.1	Very low	161 Å²	161	138.8 Å²	138.8	75%	0.752	73%	0.734	S	S	*	*				52.9	130	123.2	-63	158.9	-170.8	0	0	120.1
504	G	30.2	Very low	31.2	Very low	65 Å²	65	136.1 Å²	136.1	67%	0.67	73%	0.729	S	S	*	*			trans	141.9	69	148	0	0	0	0	0	118.4
505	T	28.9	Very low	31.3	Very low	135 Å²	135	136.7 Å²	136.7	83%	0.828	73%	0.729	S	S	*	*			trans	43.5	139.1	132.9	50.5	0	0	0	0	123.1
506	M	29.8	Very low	31.2	Very low	160 Å²	160	130.5 Å²	130.5	79%	0.788	72%	0.723	S	S	*	*			trans	91	114.3	141.1	-73.8	-78.7	178	0	0	121.5
507	N	30	Very low	31.5	Very low	125 Å²	125	123.9 Å²	123.9	67%	0.668	71%	0.712	S	S	*	*				84	103.2	128.9	-89.2	-10.4	0	0	0	123.1
508	N	32.3	Very low	31.3	Very low	127 Å²	127	122.8 Å²	122.8	68%	0.679	71%	0.706	S	S	*	*				88.1	142.1	109.1	-94.8	-5.7	0	0	0	123.2
509	N	31.3	Very low	31.3	Very low	116 Å²	116	123.3 Å²	123.3	62%	0.62	70%	0.7	S	S	*	*			trans	79.7	96.3	143.7	-67.6	-7.2	0	0	0	121
510	N	31.8	Very low	30.9	Very low	125 Å²	125	123.4 Å²	123.4	67%	0.668	70%	0.697	S	S	*	*				103.6	141.6	104.2	-76.2	-8.9	0	0	0	121.5
511	N	32.2	Very low	31	Very low	123 Å²	123	125.7 Å²	125.7	66%	0.658	71%	0.709	S	S	*	*			trans	82.1	104.4	145.7	-67.2	-6.5	0	0	0	120.9
512	N	31.4	Very low	30.9	Very low	130 Å²	130	128.8 Å²	128.8	70%	0.695	72%	0.716	S	S	*	*				78.5	129.7	120.6	-59.8	-14.2	0	0	0	121
513	S	32.4	Very low	31	Very low	111 Å²	111	126.8 Å²	126.8	78%	0.776	72%	0.718	S	S	*	*			trans	66.4	143.7	139.8	56.9	0	0	0	0	120
514	S	33.6	Very low	31.1	Very low	99 Å²	99	124.4 Å²	124.4	69%	0.692	72%	0.719	S	S	*	*			cis	-169.5	171.4	-16.5	51.8	0	0	0	0	110.7
515	S	31.6	Very low	31.4	Very low	93 Å²	93	129 Å²	129	65%	0.65	73%	0.727	S	S	*	*			trans	64.3	123.2	141.9	59.5	0	0	0	0	121
516	S	30.3	Very low	31.6	Very low	112 Å²	112	128.3 Å²	128.3	78%	0.783	73%	0.726	S	S	*	*			trans	78.6	149.7	134.7	-65.3	0	0	0	0	120.1
517	S	32.2	Very low	31.4	Very low	92 Å²	92	128.3 Å²	128.3	64%	0.643	73%	0.727	S	S	*	*			cis	-169.5	153.3	-22	-105.6	0	0	0	0	111.3
518	N	30.3	Very low	31.2	Very low	134 Å²	134	131.6 Å²	131.6	72%	0.717	73%	0.73	S	S	*	*			trans	61.6	122.5	140.9	-69.9	6.5	0	0	0	122
519	N	29.9	Very low	31	Very low	120 Å²	120	134.4 Å²	134.4	64%	0.642	73%	0.731	S	S	*	*				101.8	118.5	123.2	-72.1	0.6	0	0	0	121.1
520	N	27.5	Very low	30.7	Very low	125 Å²	125	137 Å²	137	67%	0.668	74%	0.74	S	S	*	*			trans	63.6	110	131.8	-53.2	-15.1	0	0	0	118.7
521	N	32.1	Very low	30.4	Very low	166 Å²	166	140 Å²	140	89%	0.888	75%	0.752	S	S	*	*				-174.3	151.4	95.7	-90.2	-46	0	0	0	114
522	R	32.8	Very low	30	Very low	235 Å²	235	138.9 Å²	138.9	89%	0.887	75%	0.749	S	S	*	*			trans	-90.2	150	168.1	-169.9	167.5	-177.6	-124.2	3.5	106.7
523	P	33.1	Very low	29.7	Very low	108 Å²	108	142.8 Å²	142.8	70%	0.701	76%	0.756	S	S	*	*				-161.6	-176.9	57.5	44.2	-21.4	0	0	0	120.7
524	S	28.6	Very low	29.4	Very low	112 Å²	112	142.9 Å²	142.9	78%	0.783	76%	0.756	S	S	*	*			trans	80.3	149.4	144.6	65.7	0	0	0	0	121.9
525	L	37.2	Very low	29.1	Very low	160 Å²	160	143.4 Å²	143.4	84%	0.838	75%	0.752	S	S	*	*			trans	-88	161.1	-178.4	-70.3	156.3	0	0	0	112.5
526	P	32.8	Very low	29	Very low	122 Å²	122	147.2 Å²	147.2	79%	0.792	77%	0.765	S	S	*	*			trans	-116.2	153.3	140.9	36.1	-29.4	0	0	0	113
527	I	26.4	Very low	28.8	Very low	159 Å²	159	147.1 Å²	147.1	82%	0.815	76%	0.755	S	S	*	*			trans	-105.5	156.4	177.3	-60.4	163.6	0	0	0	108.6
528	R	26	Very low	28.8	Very low	195 Å²	195	151 Å²	151	74%	0.736	77%	0.769	S	S	*	*				130.6	143.4	126.8	-145.6	-171.8	-173.1	159.9	3.4	117.6
529	R	28.2	Very low	28.6	Very low	186 Å²	186	149.7 Å²	149.7	70%	0.702	76%	0.762	S	S	*	*			trans	72	115.3	167.5	-52.6	-166.6	169	130.9	-4.5	115.1
530	Q	24.3	Very low	28.5	Very low	171 Å²	171	154.2 Å²	154.2	80%	0.799	77%	0.772	S	S	*	*			cis	70.7	110.7	50	-62.8	179.8	-44.2	0	0	115
531	M	26	Very low	28.4	Very low	186 Å²	186	151.9 Å²	151.9	92%	0.916	78%	0.777	S	S	*	*			trans	-147.7	166.4	130.9	-96.4	-56.6	-175.5	0	0	108.5
532	T	23.6	Very low	28	Very low	100 Å²	100	147.5 Å²	147.5	61%	0.613	77%	0.771	S	S	*	*			trans	-136.1	144.6	-150.2	50.4	0	0	0	0	115.8
533	Y	24.6	Very low	27.7	Very low	213 Å²	213	141.7 Å²	141.7	84%	0.835	76%	0.761	S	S	*	*			trans	54.7	153.6	152	-65.8	-60.8	0	0	0	118
534	S	26	Very low	27.3	Very low	112 Å²	112	143.7 Å²	143.7	78%	0.783	77%	0.765	S	S	*	*			cis	-154.3	171.8	35.8	-159.4	0	0	0	0	114.1
535	N	26.7	Very low	27.2	Very low	111 Å²	111	147.4 Å²	147.4	59%	0.594	76%	0.763	S	S	*	*			trans	-76.4	163.6	-175.9	-58.2	-9.6	0	0	0	113.4	N537	N535-N537 PolarHBondContact ND2-OD1 2.93Å
536	N	30.2	Very low	26.6	Very low	173 Å²	173	145.8 Å²	145.8	93%	0.925	76%	0.755	S	S	*	*				-128.2	138	128.2	-94.6	-41.8	0	0	0	108.4
537	N	26.1	Very low	26.4	Very low	109 Å²	109	147.2 Å²	147.2	58%	0.583	75%	0.751	S	S	*	*			trans	-94.7	138.2	-175.7	-63	-16.8	0	0	0	110.6	N535	N535-N537 PolarHBondContact ND2-OD1 2.93Å
538	D	33.3	Very low	26.4	Very low	174 Å²	174	147.2 Å²	147.2	93%	0.93	75%	0.753	S	S	*	*			trans	-122.8	95	147.1	-88.2	-49	0	0	0	108.9
539	N	26.3	Very low	26.3	Very low	106 Å²	106	143.4 Å²	143.4	57%	0.567	75%	0.747	S	S	*	*			trans	-46	153.9	166.9	-84.2	-16.7	0	0	0	112.9
540	Y	26.2	Very low	26.3	Very low	216 Å²	216	140 Å²	140	85%	0.847	74%	0.742	S	S	*	*			cis	-139.8	160.1	2.5	-73.9	-84.6	0	0	0	108
541	G	26.6	Very low	26.5	Very low	76 Å²	76	140.4 Å²	140.4	78%	0.784	74%	0.744	S	S	*	*			cis	-176.4	131.1	-5.4	0	0	0	0	0	109.3
542	G	23.3	Very low	26.6	Very low	73 Å²	73	135.1 Å²	135.1	75%	0.753	74%	0.737	S	S	*	*			trans	-108.5	137.3	-177.3	0	0	0	0	0	112.8
543	T	27.4	Very low	26.9	Very low	113 Å²	113	134.7 Å²	134.7	69%	0.693	73%	0.73	S	S	*	*			trans	-135.8	126.9	162.6	50.3	0	0	0	0	105	Y545	T543-Y545 HydrophobicContact CG2-CD2 4.12Å; T543-Y545 HydrophobicContact CG2-CE2 3.77Å
544	I	23.3	Very low	27.4	Very low	151 Å²	151	128.4 Å²	128.4	77%	0.774	72%	0.715	S	S	*	*			cis	50.4	79.4	32.8	-44.7	178.2	0	0	0	111
545	Y	27.2	Very low	28.2	Very low	190 Å²	190	130 Å²	130	75%	0.745	71%	0.708	S	S	*	*			trans	-154.9	116.4	143.5	-81.2	-55.3	0	0	0	112.2	T543	T543-Y545 HydrophobicContact CG2-CD2 4.12Å; T543-Y545 HydrophobicContact CG2-CE2 3.77Å
546	N	25.5	Very low	29.1	Very low	126 Å²	126	125.3 Å²	125.3	67%	0.674	68%	0.683	S	S	*	*			trans	30.1	122.3	131.9	-70.4	5.9	0	0	0	119.4
547	H	26.7	Very low	30	Very low	152 Å²	152	119.9 Å²	119.9	70%	0.704	66%	0.658	S	S	*	*	S	Bend	trans	-48	142.2	139.5	-70.9	-110.4	0	0	0	109.2
548	N	26.5	Very low	31.2	Very low	159 Å²	159	121.1 Å²	121.1	85%	0.85	66%	0.655	S	S	*	*	S	Bend	trans	83.2	31.4	-166.1	-48.5	-40.6	0	0	0	116.6
549	N	24.5	Very low	32.5	Very low	115 Å²	115	116 Å²	116	62%	0.615	62%	0.622	S	S	*	*			trans	-152.7	46.9	155.4	-123.1	-11.4	0	0	0	116.6	Q551	N549-Q551 PolarHBondContact O-N 3.42Å
550	L	27.9	Very low	34.3	Very low	115 Å²	115	111.7 Å²	111.7	60%	0.602	60%	0.599	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.2	34	177.7	-94.7	92.6	0	0	0	115.3
551	Q	29.1	Very low	35.8	Very low	178 Å²	178	105.2 Å²	105.2	83%	0.832	58%	0.579	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86	-9.2	173.6	-67.2	-172.5	-10.6	0	0	113.7	N549	N549-Q551 PolarHBondContact O-N 3.42Å
552	G	28.5	Very low	37.4	Very low	75 Å²	75	107.8 Å²	107.8	77%	0.773	57%	0.569	S	S	*	*	S	Bend	trans	-90.9	-13.5	-172.3	0	0	0	0	0	117.4
553	I	29.8	Very low	39.3	Very low	91 Å²	91	104.6 Å²	104.6	47%	0.467	54%	0.535	S	S	.	.	S	Bend	trans	-91.2	125.5	170.6	-59.2	173.9	0	0	0	107.1	K555	I553-K555 PolarHBondContact O-N 3.27Å; I553-K555 VanDerWaalsContact O-N 3.1Å
554	P	34.6	Very low	41	Very low	81 Å²	81	104.3 Å²	104.3	53%	0.526	52%	0.521	S	S	.	.			trans	-59.7	119.8	177.4	24.1	-33	0	0	0	109.7	F556 S557	P554-F556 PolarHBondContact O-N 2.98Å; P554-F556 VanDerWaalsContact O-N 3.09Å; P554-S557 PolarHBondContact O-N 3.17Å
555	K	42.3	Very low	42.7	Very low	146 Å²	146	103 Å²	103	64%	0.635	51%	0.511	S	S	*	.	H	α-helix	trans	-48.3	-41	-179.2	-66.8	177.2	179.4	176.1	0	111.2	I553 S557 R558 R559	I553-K555 PolarHBondContact O-N 3.27Å; I553-K555 VanDerWaalsContact O-N 3.1Å; K555-S557 VanDerWaalsContact C-N 3.32Å; K555-S557 PolarHBondContact O-N 3.32Å; K555-R558 PolarHBondContact O-N 2.94Å; K555-R558 VanDerWaalsContact O-N 3.16Å; K555-R559 PolarHBondContact O-N 3.4Å
556	F	45.2	Very low	44	Very low	13 Å²	13	100.2 Å²	100.2	6%	0.057	50%	0.5	C	S	.	.	H	α-helix	trans	-38.2	-49.5	169.8	-168.7	-112.3	0	0	0	115.3	P554 R558 R559 L560 L630 E631 D636 K659	P554-F556 PolarHBondContact O-N 2.98Å; P554-F556 VanDerWaalsContact O-N 3.09Å; F556-R558 VanDerWaalsContact C-N 3.35Å; F556-R558 PolarHBondContact O-N 2.92Å; F556-R559 PolarHBondContact O-N 3.37Å; F556-R559 VanDerWaalsContact O-N 3.12Å; F556-L560 HydrophobicContact CD1-CD1 4.03Å; F556-L560 HydrophobicContact CD1-CG 4.43Å; F556-L560 HydrophobicContact CE1-CD1 3.23Å; F556-L560 HydrophobicContact CE1-CG 3.79Å; F556-L560 HydrophobicContact CE2-CD1 4.39Å; F556-L560 HydrophobicContact CE2-CG 4.05Å; F556-L560 HydrophobicContact CZ-CD1 3.46Å; F556-L560 VanDerWaalsContact CZ-CD1 3.46Å; F556-L560 HydrophobicContact CZ-CD2 4.26Å; F556-L560 HydrophobicContact CZ-CG 3.56Å; F556-L560 PolarHBondContact O-N 3.09Å; F556-L630 HydrophobicContact CE2-CB 3.86Å; F556-L630 HydrophobicContact CE2-CD1 4.06Å; F556-L630 HydrophobicContact CE2-CD2 4.31Å; F556-L630 HydrophobicContact CE2-CG 4.32Å; F556-L630 HydrophobicContact CZ-CB 4.47Å; F556-L630 HydrophobicContact CZ-CD1 4.25Å; F556-E631 WeakPolarHBondContact CD1-OE1 3.45Å; F556-E631 HydrophobicContact CD2-CG 4.49Å; F556-E631 WeakPolarHBondContact CE1-OE1 3.4Å; F556-E631 HydrophobicContact CE2-CG 4.49Å; F556-E631 WeakPolarHBondContact CG-OE1 3.38Å; F556-D636 PolarHBondContact N-OD2 3.17Å; F556-K659 HydrophobicContact CE1-CD 4.24Å; F556-K659 HydrophobicContact CZ-CD 3.91Å
557	S	50.3	Low	45.8	Very low	58 Å²	58	96.3 Å²	96.3	41%	0.406	48%	0.476	S	S	.	.	H	α-helix	trans	-65	-35.6	-175.6	-66.4	0	0	0	0	113.3	P554 K555 N561	P554-S557 PolarHBondContact O-N 3.17Å; K555-S557 VanDerWaalsContact C-N 3.32Å; K555-S557 PolarHBondContact O-N 3.32Å; S557-N561 PolarHBondContact O-N 3.36Å
558	R	50.8	Low	47.2	Very low	136 Å²	136	96.6 Å²	96.6	51%	0.513	48%	0.477	S	S	.	.	H	α-helix	trans	-69.2	-40.5	173.8	-69.3	-178	175.9	174.2	-2.8	110.9	K555 F556 N561 F562	K555-R558 PolarHBondContact O-N 2.94Å; K555-R558 VanDerWaalsContact O-N 3.16Å; F556-R558 VanDerWaalsContact C-N 3.35Å; F556-R558 PolarHBondContact O-N 2.92Å; R558-N561 PolarHBondContact O-N 2.97Å; R558-F562 VanDerWaalsContact O-CD2 3.22Å; R558-F562 WeakPolarHBondContact O-CD2 3.47Å; R558-F562 PolarHBondContact O-N 3.13Å; R558-F562 VanDerWaalsContact O-N 3.08Å
559	R	61.6	Low	49	Very low	65 Å²	65	92.3 Å²	92.3	25%	0.245	45%	0.454	C	S	.	.	H	α-helix	trans	-70.5	-39.2	-179.8	-71.9	-179.8	166.7	162.1	-9.1	113.5	K555 F556 N561 F562 I563 Y638 D639	K555-R559 PolarHBondContact O-N 3.4Å; F556-R559 PolarHBondContact O-N 3.37Å; F556-R559 VanDerWaalsContact O-N 3.12Å; R559-N561 VanDerWaalsContact C-N 3.25Å; R559-N561 PolarHBondContact O-N 3.45Å; R559-F562 PolarHBondContact O-N 2.96Å; R559-I563 WeakPolarHBondContact O-CG1 3.42Å; R559-I563 PolarHBondContact O-N 3.26Å; R559-Y638 HydrophobicContact CB-CD2 4.35Å; R559-Y638 HydrophobicContact CB-CE2 4.09Å; R559-D639 IonicContact CZ-OD1 2.7Å; R559-D639 VanDerWaalsContact CZ-OD1 3.27Å; R559-D639 IonicContact CZ-OD2 3.24Å; R559-D639 IonicContact NH1-OD1 3.3Å; R559-D639 PolarHBondContact NH1-OD1 2.94Å; R559-D639 IonicContact NH1-OD2 3.15Å; R559-D639 PolarHBondContact NH1-OD2 3.03Å; R559-D639 IonicContact NH2-OD1 3.67Å; R559-D639 PolarHBondContact NH2-OD1 3.11Å; R559-D639 IonicContact NH2-OD2 2.69Å; R559-D639 PolarHBondContact NH2-OD2 3.44Å
560	L	63.3	Low	51.4	Low	16 Å²	16	89.2 Å²	89.2	8%	0.084	44%	0.435	C	S	.	.	H	α-helix	trans	-58.4	-39.5	170.6	-101.8	-174.5	0	0	0	111.5	F556 I563 R564 L572	F556-L560 HydrophobicContact CD1-CD1 4.03Å; F556-L560 HydrophobicContact CD1-CG 4.43Å; F556-L560 HydrophobicContact CE1-CD1 3.23Å; F556-L560 HydrophobicContact CE1-CG 3.79Å; F556-L560 HydrophobicContact CE2-CD1 4.39Å; F556-L560 HydrophobicContact CE2-CG 4.05Å; F556-L560 HydrophobicContact CZ-CD1 3.46Å; F556-L560 VanDerWaalsContact CZ-CD1 3.46Å; F556-L560 HydrophobicContact CZ-CD2 4.26Å; F556-L560 HydrophobicContact CZ-CG 3.56Å; F556-L560 PolarHBondContact O-N 3.09Å; L560-I563 PolarHBondContact O-N 2.94Å; L560-R564 WeakPolarHBondContact O-CB 3.21Å; L560-R564 WeakPolarHBondContact O-CD 3.37Å; L560-R564 WeakPolarHBondContact O-CG 3.25Å; L560-R564 PolarHBondContact O-N 3.39Å; L560-L572 HydrophobicContact CD1-CD2 4.45Å; L560-L572 HydrophobicContact CD2-CD1 4.42Å; L560-L572 HydrophobicContact CD2-CD2 4.29Å
561	N	57.2	Low	53.7	Low	80 Å²	80	85.9 Å²	85.9	43%	0.428	42%	0.42	S	S	.	.	H	α-helix	trans	-68.9	-40	177.3	-72.5	-4.3	0	0	0	112	S557 R558 R559 I563 R564 Q565	S557-N561 PolarHBondContact O-N 3.36Å; R558-N561 PolarHBondContact O-N 2.97Å; R559-N561 VanDerWaalsContact C-N 3.25Å; R559-N561 PolarHBondContact O-N 3.45Å; N561-I563 PolarHBondContact O-N 2.93Å; N561-R564 WeakPolarHBondContact O-CB 3.49Å; N561-R564 PolarHBondContact O-N 2.7Å; N561-R564 PolarHBondContact OD1-NH1 2.81Å; N561-Q565 WeakPolarHBondContact O-CG 3.33Å; N561-Q565 PolarHBondContact O-N 3.43Å
562	F	60	Low	56.3	Low	131 Å²	131	78.7 Å²	78.7	58%	0.575	39%	0.387	S	S	*	.	H	α-helix	trans	-61.1	-40.3	170.6	-77.5	-62.5	0	0	0	113.1	R558 R559 Q565 R566	R558-F562 VanDerWaalsContact O-CD2 3.22Å; R558-F562 WeakPolarHBondContact O-CD2 3.47Å; R558-F562 PolarHBondContact O-N 3.13Å; R558-F562 VanDerWaalsContact O-N 3.08Å; R559-F562 PolarHBondContact O-N 2.96Å; F562-Q565 PolarHBondContact O-N 3.1Å; F562-R566 WeakPolarHBondContact O-CB 3.3Å; F562-R566 PolarHBondContact O-N 3.04Å; F562-R566 VanDerWaalsContact O-N 3.1Å
563	I	63.1	Low	59	Low	6 Å²	6	77.7 Å²	77.7	3%	0.031	36%	0.36	C	S	.	.	H	α-helix	trans	-62.7	-48.4	173.9	-72.9	166.1	0	0	0	110.6	R559 L560 N561 Q565 R566 Y567 Y638 I661 F663	R559-I563 WeakPolarHBondContact O-CG1 3.42Å; R559-I563 PolarHBondContact O-N 3.26Å; L560-I563 PolarHBondContact O-N 2.94Å; N561-I563 PolarHBondContact O-N 2.93Å; I563-Q565 PolarHBondContact O-N 2.87Å; I563-R566 PolarHBondContact O-N 3.31Å; I563-Y567 HydrophobicContact CG2-CD2 4.27Å; I563-Y567 PolarHBondContact O-N 3.18Å; I563-Y638 HydrophobicContact CD1-CE2 3.67Å; I563-Y638 WeakPolarHBondContact CD1-OH 3.48Å; I563-I661 HydrophobicContact CD1-CD1 4.4Å; I563-I661 HydrophobicContact CG2-CD1 3.62Å; I563-F663 HydrophobicContact CG2-CE1 4.06Å; I563-F663 HydrophobicContact CG2-CZ 4.49Å
564	R	63.9	Low	61.8	Low	107 Å²	107	76.5 Å²	76.5	40%	0.404	36%	0.36	S	S	.	.	H	α-helix	trans	-57.1	-35	178	-79.2	163.2	167.8	-176.9	-7.3	113.3	L560 N561 Y570	L560-R564 WeakPolarHBondContact O-CB 3.21Å; L560-R564 WeakPolarHBondContact O-CD 3.37Å; L560-R564 WeakPolarHBondContact O-CG 3.25Å; L560-R564 PolarHBondContact O-N 3.39Å; N561-R564 WeakPolarHBondContact O-CB 3.49Å; N561-R564 PolarHBondContact O-N 2.7Å; N561-R564 PolarHBondContact OD1-NH1 2.81Å; R564-Y570 HydrophobicContact CG-CE1 4.15Å; R564-Y570 VanDerWaalsContact CG-OH 3.3Å; R564-Y570 WeakPolarHBondContact CG-OH 3.43Å; R564-Y570 PolarHBondContact NE-OH 2.83Å
565	Q	59	Low	64.4	Low	123 Å²	123	73.1 Å²	73.1	58%	0.575	34%	0.337	S	S	*	.	H	α-helix	trans	-77.1	-30	176.5	-73.6	172.6	-24.4	0	0	112.8	D321 N561 F562 I563	D321-Q565 PolarHBondContact OD2-NE2 2.93Å; D321-Q565 VanDerWaalsContact OD2-NE2 3.15Å; N561-Q565 WeakPolarHBondContact O-CG 3.33Å; N561-Q565 PolarHBondContact O-N 3.43Å; F562-Q565 PolarHBondContact O-N 3.1Å; I563-Q565 PolarHBondContact O-N 2.87Å
566	R	55.1	Low	66.6	Low	132 Å²	132	71 Å²	71	50%	0.498	33%	0.332	S	S	.	.	H	α-helix	trans	-101.5	-23.6	-170.7	-168.2	166.7	-177	79.6	-6.6	115.1	F562 I563	F562-R566 WeakPolarHBondContact O-CB 3.3Å; F562-R566 PolarHBondContact O-N 3.04Å; F562-R566 VanDerWaalsContact O-N 3.1Å; I563-R566 PolarHBondContact O-N 3.31Å
567	Y	61.7	Low	68.7	Low	43 Å²	43	70.5 Å²	70.5	17%	0.169	33%	0.33	C	S	.	.			trans	-125.2	109.7	-177.6	-64.1	-82.3	0	0	0	110.5	I563 Y570 N602 F663	I563-Y567 HydrophobicContact CG2-CD2 4.27Å; I563-Y567 PolarHBondContact O-N 3.18Å; Y567-Y570 WeakPolarHBondContact O-CD1 3.34Å; Y567-N602 PolarHBondContact OH-O 3.4Å; Y567-F663 AromaticContact CD1-CD1 3.81Å; Y567-F663 HydrophobicContact CD1-CD1 3.81Å; Y567-F663 HydrophobicContact CD1-CE1 4.1Å; Y567-F663 HydrophobicContact CD2-CD1 4.29Å; Y567-F663 AromaticContact CD2-CE1 3.73Å; Y567-F663 HydrophobicContact CD2-CE1 3.73Å; Y567-F663 HydrophobicContact CD2-CZ 4.49Å; Y567-F663 HydrophobicContact CE1-CD1 4.4Å; Y567-F663 HydrophobicContact CE2-CE1 4.22Å; Y567-F663 AromaticContact CG-CD1 3.75Å; Y567-F663 HydrophobicContact CG-CD1 3.75Å; Y567-F663 AromaticContact CG-CE1 3.65Å; Y567-F663 HydrophobicContact CG-CE1 3.65Å
568	Q	56.4	Low	70.3	Confident	158 Å²	158	73 Å²	73	74%	0.738	34%	0.335	S	S	*	.	S	Bend	trans	-72	-35.4	-178.4	-68.3	174.9	-14.4	0	0	112.7
569	N	64.3	Low	71.9	Confident	69 Å²	69	69.3 Å²	69.3	37%	0.369	32%	0.321	S	S	.	.	S	Bend	trans	-108.8	90.3	-178.4	-63	-16.1	0	0	0	110.8	Q664	N569-Q664 HydrophobicContact CB-CB 4.47Å; N569-Q664 PolarHBondContact O-N 2.96Å
570	Y	75.1	Confident	72.6	Confident	51 Å²	51	67.3 Å²	67.3	20%	0.2	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	147.2	173.4	75.3	-81.7	0	0	0	112.3	R564 Y567 L572 I661 N662	R564-Y570 HydrophobicContact CG-CE1 4.15Å; R564-Y570 VanDerWaalsContact CG-OH 3.3Å; R564-Y570 WeakPolarHBondContact CG-OH 3.43Å; R564-Y570 PolarHBondContact NE-OH 2.83Å; Y567-Y570 WeakPolarHBondContact O-CD1 3.34Å; Y570-L572 HydrophobicContact CD2-CB 4.29Å; Y570-L572 HydrophobicContact CE2-CB 4.11Å; Y570-I661 HydrophobicContact CD2-CD1 3.54Å; Y570-I661 HydrophobicContact CD2-CG1 4Å; Y570-I661 HydrophobicContact CE2-CD1 4.44Å; Y570-I661 HydrophobicContact CG-CD1 3.99Å; Y570-I661 HydrophobicContact CG-CG1 4.46Å; Y570-N662 CarbonylContact C-O 3.37Å; Y570-N662 WeakPolarHBondContact CA-O 3.42Å
571	C	77.6	Confident	73.2	Confident	45 Å²	45	73.2 Å²	73.2	30%	0.304	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	97.8	177.2	-175.2	0	0	0	0	110.1	I661 N662	C571-I661 WeakPolarHBondContact O-CA 3.33Å; C571-N662 HydrophobicContact CB-CB 4.16Å; C571-N662 PolarHBondContact N-O 3.43Å; C571-N662 PolarHBondContact O-N 2.95Å
572	L	83.7	Confident	73.9	Confident	26 Å²	26	72.6 Å²	72.6	14%	0.136	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	123.9	173	-175.7	73.6	0	0	0	109.8	Q21 L560 Y570 L630 K659 I660 I661	Q21-L572 PolarHBondContact NE2-O 2.68Å; L560-L572 HydrophobicContact CD1-CD2 4.45Å; L560-L572 HydrophobicContact CD2-CD1 4.42Å; L560-L572 HydrophobicContact CD2-CD2 4.29Å; Y570-L572 HydrophobicContact CD2-CB 4.29Å; Y570-L572 HydrophobicContact CE2-CB 4.11Å; L572-L630 HydrophobicContact CD1-CD1 3.43Å; L572-L630 VanDerWaalsContact CD1-CD1 3.43Å; L572-K659 HydrophobicContact CD1-CG 4.4Å; L572-I660 CarbonylContact C-O 3.49Å; L572-I660 WeakPolarHBondContact CA-O 3.28Å; L572-I661 HydrophobicContact CD1-CB 4.38Å
573	R	84.5	Confident	75	Confident	55 Å²	55	66.5 Å²	66.5	21%	0.208	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	150.4	177.6	-51.8	-169.3	-62.3	-64.9	11.9	110.3	I575 G622 D627 K659 I660	R573-I575 HydrophobicContact CB-CG2 4.45Å; R573-G622 PolarHBondContact NE-O 2.97Å; R573-G622 VanDerWaalsContact NE-O 3.13Å; R573-G622 PolarHBondContact NH2-O 3.25Å; R573-D627 IonicContact CZ-OD1 2.67Å; R573-D627 IonicContact CZ-OD2 3.92Å; R573-D627 IonicContact NH1-OD1 2.64Å; R573-D627 PolarHBondContact NH1-OD1 2.96Å; R573-D627 IonicContact NH2-OD1 3.66Å; R573-D627 PolarHBondContact NH2-OD1 3.14Å; R573-D627 IonicContact NH2-OD2 3.49Å; R573-D627 PolarHBondContact NH2-OD2 3.21Å; R573-K659 WeakPolarHBondContact O-CA 3.4Å; R573-I660 HydrophobicContact CB-CD1 4.2Å; R573-I660 HydrophobicContact CB-CG1 3.84Å; R573-I660 PolarHBondContact N-O 3.28Å; R573-I660 PolarHBondContact O-N 2.99Å
574	S	88.3	Confident	76.1	Confident	65 Å²	65	66.7 Å²	66.7	46%	0.455	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	119.2	167.8	-58.3	0	0	0	0	107.6	L658	S574-L658 WeakPolarHBondContact CA-O 3.17Å
575	I	89	Confident	77.2	Confident	11 Å²	11	61.9 Å²	61.9	6%	0.056	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	155.3	-177.1	70	168.5	0	0	0	110	R573 L577 A621 L623 Q657 L658 I660	R573-I575 HydrophobicContact CB-CG2 4.45Å; I575-L577 HydrophobicContact CD1-CD1 4.15Å; I575-L577 HydrophobicContact CD1-CD2 4.06Å; I575-L577 HydrophobicContact CD1-CG 4.11Å; I575-A621 HydrophobicContact CB-CB 4.41Å; I575-A621 HydrophobicContact CD1-CB 4.49Å; I575-A621 VanDerWaalsContact CG2-O 3.26Å; I575-A621 WeakPolarHBondContact CG2-O 3.34Å; I575-L623 HydrophobicContact CD1-CB 3.82Å; I575-L623 HydrophobicContact CD1-CD1 3.82Å; I575-L623 HydrophobicContact CD1-CG 4.28Å; I575-Q657 CarbonylContact O-C 3.57Å; I575-Q657 WeakPolarHBondContact O-CA 3.32Å; I575-L658 HydrophobicContact CD1-CB 4.46Å; I575-L658 HydrophobicContact CD1-CD1 4.45Å; I575-L658 HydrophobicContact CG1-CB 3.89Å; I575-L658 PolarHBondContact N-O 3.41Å; I575-L658 PolarHBondContact O-N 3.28Å; I575-I660 HydrophobicContact CD1-CD1 4.11Å; I575-I660 HydrophobicContact CG1-CD1 4.37Å; I575-I660 HydrophobicContact CG2-CD1 4.1Å
576	I	89.6	Confident	78.7	Confident	102 Å²	102	56.8 Å²	56.8	52%	0.523	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	123.4	176.2	-56.4	177.7	0	0	0	107.7	M655 Q657	I576-M655 HydrophobicContact CG2-CE 3.54Å; I576-Q657 HydrophobicContact CG1-CB 4.31Å; I576-Q657 HydrophobicContact CG1-CG 4.15Å
577	L	88.5	Confident	80.2	Confident	1 Å²	1	52.8 Å²	52.8	1%	0.005	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	114.4	-177.4	-58.3	-179.5	0	0	0	109.3	I575 Y584 F586 A618 A621 L656 L658	I575-L577 HydrophobicContact CD1-CD1 4.15Å; I575-L577 HydrophobicContact CD1-CD2 4.06Å; I575-L577 HydrophobicContact CD1-CG 4.11Å; L577-Y584 HydrophobicContact CB-CD1 3.83Å; L577-Y584 HydrophobicContact CB-CE1 4.44Å; L577-Y584 WeakPolarHBondContact O-CE1 3.23Å; L577-F586 HydrophobicContact CD1-CD1 4.02Å; L577-F586 HydrophobicContact CD1-CE1 3.55Å; L577-A618 HydrophobicContact CD1-CB 4.35Å; L577-A618 HydrophobicContact CD2-CB 4.41Å; L577-A621 HydrophobicContact CD2-CB 3.4Å; L577-A621 VanDerWaalsContact CD2-CB 3.4Å; L577-L656 HydrophobicContact CB-CB 4.38Å; L577-L656 HydrophobicContact CD1-CD2 4.49Å; L577-L656 PolarHBondContact N-O 3.39Å; L577-L656 PolarHBondContact O-N 2.78Å; L577-L658 HydrophobicContact CD1-CD1 4Å
578	E	84.7	Confident	81.5	Confident	110 Å²	110	50.9 Å²	50.9	51%	0.514	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	141.6	162.5	-168.5	-155.4	161.4	0	0	108.7	K617 M655	E578-K617 HydrophobicContact CB-CD 4.25Å; E578-K617 WeakPolarHBondContact O-CD 3.33Å; E578-K617 IonicContact OE1-NZ 2.7Å; E578-K617 PolarHBondContact OE1-NZ 2.91Å; E578-K617 IonicContact OE2-NZ 2.79Å; E578-K617 PolarHBondContact OE2-NZ 3.16Å; E578-M655 VanDerWaalsContact CA-SD 3.55Å; E578-M655 HydrophobicContact CB-SD 3.62Å; E578-M655 HydrophobicContact CG-SD 3.77Å
579	R	84.2	Confident	82.8	Confident	59 Å²	59	47.5 Å²	47.5	22%	0.223	26%	0.256	C	S	.	.			trans	-64.7	145.1	178.2	-171.6	170.4	167.9	-177.9	-8.1	111.4	Y584 K617 K653 D654	R579-Y584 HydrophobicContact CB-CD1 4.27Å; R579-Y584 HydrophobicContact CB-CE1 3.68Å; R579-Y584 HydrophobicContact CG-CE1 4.33Å; R579-K617 PolarHBondContact O-NZ 2.91Å; R579-K653 WeakPolarHBondContact CD-O 3.35Å; R579-K653 PolarHBondContact NH1-O 3.48Å; R579-D654 PolarHBondContact N-O 3.17Å
580	G	76.4	Confident	83.5	Confident	23 Å²	23	44.8 Å²	44.8	24%	0.237	24%	0.244	C	C	.	.	B	Isolated β-bridge	trans	-108.2	176	169.1	0	0	0	0	0	111.9	T582 G583	G580-T582 PolarHBondContact O-N 3.25Å; G580-G583 CarbonylContact C-O 3.6Å; G580-G583 VanDerWaalsContact CA-O 3.3Å; G580-G583 WeakPolarHBondContact CA-O 3.46Å; G580-G583 PolarHBondContact N-O 2.82Å; G580-G583 PolarHBondContact O-N 3Å; G580-G583 VanDerWaalsContact O-N 3.08Å
581	T	75	Confident	83.2	Confident	141 Å²	141	43.5 Å²	43.5	87%	0.865	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.6	-25	177.9	46.1	0	0	0	0	113.7
582	T	71.6	Confident	82.7	Confident	66 Å²	66	43.7 Å²	43.7	41%	0.405	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101.9	10.2	177.7	54	0	0	0	0	113.5	G580	G580-T582 PolarHBondContact O-N 3.25Å
583	G	83.5	Confident	81.5	Confident	3 Å²	3	46.1 Å²	46.1	3%	0.031	25%	0.253	C	S	.	.	B	Isolated β-bridge	trans	96.3	-149.8	-167	0	0	0	0	0	111.9	G580	G580-G583 CarbonylContact C-O 3.6Å; G580-G583 VanDerWaalsContact CA-O 3.3Å; G580-G583 WeakPolarHBondContact CA-O 3.46Å; G580-G583 PolarHBondContact N-O 2.82Å; G580-G583 PolarHBondContact O-N 3Å; G580-G583 VanDerWaalsContact O-N 3.08Å
584	Y	86.9	Confident	80	Confident	11 Å²	11	50 Å²	50	4%	0.043	27%	0.272	C	S	.	.	S	Bend	trans	-89.4	-12.1	-174.2	-65.7	-73.2	0	0	0	114.9	L577 R579 F586 A618 I649 T652 L656	L577-Y584 HydrophobicContact CB-CD1 3.83Å; L577-Y584 HydrophobicContact CB-CE1 4.44Å; L577-Y584 WeakPolarHBondContact O-CE1 3.23Å; R579-Y584 HydrophobicContact CB-CD1 4.27Å; R579-Y584 HydrophobicContact CB-CE1 3.68Å; R579-Y584 HydrophobicContact CG-CE1 4.33Å; Y584-F586 HydrophobicContact CG-CE1 4.44Å; Y584-A618 WeakPolarHBondContact O-CB 3.39Å; Y584-I649 HydrophobicContact CD2-CG2 3.99Å; Y584-I649 HydrophobicContact CE2-CG2 4.05Å; Y584-T652 PolarHBondContact OH-O 3.01Å; Y584-T652 VanDerWaalsContact OH-O 3.1Å; Y584-L656 HydrophobicContact CD1-CB 4.06Å; Y584-L656 HydrophobicContact CD1-CD2 4.21Å; Y584-L656 HydrophobicContact CD2-CD2 3.72Å; Y584-L656 HydrophobicContact CE1-CB 3.58Å; Y584-L656 HydrophobicContact CE1-CD2 4.4Å; Y584-L656 HydrophobicContact CE2-CB 4.1Å; Y584-L656 HydrophobicContact CE2-CD2 3.94Å; Y584-L656 HydrophobicContact CG-CD2 3.87Å
585	G	86.6	Confident	78.1	Confident	5 Å²	5	55.3 Å²	55.3	5%	0.052	29%	0.287	C	S	.	.	S	Bend	trans	91.9	24.6	172.1	0	0	0	0	0	116.5	Q613	G585-Q613 WeakPolarHBondContact O-CB 3.48Å; G585-Q613 PolarHBondContact O-N 3.24Å
586	F	90	Very high	76	Confident	17 Å²	17	58.3 Å²	58.3	8%	0.075	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	161.8	176.1	63.6	-91.3	0	0	0	112.4	L577 Y584 M588 I609 S611 V612 A618 L623 I649 L656 L658	L577-F586 HydrophobicContact CD1-CD1 4.02Å; L577-F586 HydrophobicContact CD1-CE1 3.55Å; Y584-F586 HydrophobicContact CG-CE1 4.44Å; F586-M588 HydrophobicContact CD2-CG 3.83Å; F586-M588 HydrophobicContact CE2-CG 3.62Å; F586-M588 HydrophobicContact CE2-SD 3.89Å; F586-I609 HydrophobicContact CD2-CD1 3.87Å; F586-I609 HydrophobicContact CE2-CD1 4.18Å; F586-S611 WeakPolarHBondContact CA-O 3.47Å; F586-V612 HydrophobicContact CB-CG2 4.25Å; F586-A618 HydrophobicContact CB-CB 4.37Å; F586-A618 HydrophobicContact CD1-CB 4Å; F586-L623 HydrophobicContact CB-CD2 3.71Å; F586-L623 HydrophobicContact CD1-CD2 3.54Å; F586-L623 HydrophobicContact CD2-CD2 4.12Å; F586-L623 HydrophobicContact CE1-CD2 4.16Å; F586-L623 HydrophobicContact CG-CD2 3.52Å; F586-I649 HydrophobicContact CE2-CD1 4.5Å; F586-I649 HydrophobicContact CZ-CD1 4.32Å; F586-L656 HydrophobicContact CE1-CD2 4.16Å; F586-L656 HydrophobicContact CZ-CD2 3.99Å; F586-L658 HydrophobicContact CE1-CD1 4.19Å; F586-L658 HydrophobicContact CZ-CD1 3.93Å
587	I	86.5	Confident	73.8	Confident	47 Å²	47	56.8 Å²	56.8	24%	0.241	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	135.9	175.1	-54.4	-177.3	0	0	0	108.5	L610 S611	I587-L610 HydrophobicContact CG2-CD2 4.41Å; I587-L610 PolarHBondContact O-N 2.72Å; I587-S611 PolarHBondContact N-O 2.93Å; I587-S611 PolarHBondContact O-N 2.72Å
588	M	88.6	Confident	71.2	Confident	4 Å²	4	61.3 Å²	61.3	2%	0.02	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	159.8	177.8	-57.2	-176.7	-60.3	0	0	111.9	F586 S608 I609 I629 V645 V646 I649 L826	F586-M588 HydrophobicContact CD2-CG 3.83Å; F586-M588 HydrophobicContact CE2-CG 3.62Å; F586-M588 HydrophobicContact CE2-SD 3.89Å; M588-S608 CarbonylContact C-O 3.33Å; M588-S608 VanDerWaalsContact CA-O 3.27Å; M588-S608 WeakPolarHBondContact CA-O 3.5Å; M588-I609 HydrophobicContact CG-CD1 4.1Å; M588-I629 HydrophobicContact CG-CD1 4.38Å; M588-I629 HydrophobicContact SD-CD1 3.48Å; M588-I629 WeakPolarHBondContact SD-CD1 3.38Å; M588-V645 HydrophobicContact CE-CG1 3.99Å; M588-V645 HydrophobicContact SD-CG1 4.08Å; M588-V646 HydrophobicContact CE-CG2 4.04Å; M588-I649 HydrophobicContact CE-CD1 3.67Å; M588-I649 HydrophobicContact SD-CD1 3.73Å; M588-L826 HydrophobicContact CE-CD1 4.39Å
589	Q	84.1	Confident	68.9	Low	87 Å²	87	64.9 Å²	64.9	41%	0.407	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	140.6	165.2	-174.7	177.5	4.7	0	0	110	Q607 S608 L610	Q589-Q607 WeakPolarHBondContact O-CA 3.41Å; Q589-S608 PolarHBondContact N-O 3.03Å; Q589-S608 PolarHBondContact O-N 3.03Å; Q589-L610 HydrophobicContact CB-CB 4.35Å
590	G	79.1	Confident	66.7	Low	12 Å²	12	67.2 Å²	67.2	12%	0.124	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.1	-180	171.7	0	0	0	0	0	111.7
591	S	69.5	Low	65	Low	24 Å²	24	69.8 Å²	69.8	17%	0.168	37%	0.369	C	S	.	.			trans	-119.6	133.4	168.3	177.7	0	0	0	0	110	N593 E596	S591-N593 VanDerWaalsContact C-N 3.26Å; S591-N593 PolarHBondContact OG-N 3.38Å; S591-E596 PolarHBondContact OG-OE2 2.87Å
592	D	67	Low	64	Low	49 Å²	49	66.7 Å²	66.7	26%	0.262	35%	0.347	S	S	.	.	S	Bend	trans	-75.2	-14.9	169.8	-67.8	-41.5	0	0	0	112	F594 H642 K643 Q822	D592-F594 PolarHBondContact O-N 3.04Å; D592-H642 WeakPolarHBondContact OD1-CB 3.35Å; D592-H642 PolarHBondContact OD1-N 2.99Å; D592-K643 PolarHBondContact OD1-N 3.14Å; D592-Q822 PolarHBondContact OD2-NE2 2.88Å
593	N	57.7	Low	63.6	Low	77 Å²	77	68.9 Å²	68.9	41%	0.412	36%	0.357	S	S	.	.			trans	-91.2	98.6	-174.3	-85.4	-24.5	0	0	0	112.6	S591 K595 E596	S591-N593 VanDerWaalsContact C-N 3.26Å; S591-N593 PolarHBondContact OG-N 3.38Å; N593-K595 PolarHBondContact O-N 3.2Å; N593-E596 HydrophobicContact CB-CB 4.2Å; N593-E596 VanDerWaalsContact CB-CD 3.45Å; N593-E596 HydrophobicContact CB-CG 3.83Å; N593-E596 PolarHBondContact ND2-OE1 2.88Å; N593-E596 PolarHBondContact O-N 3.3Å
594	F	53.8	Low	63	Low	136 Å²	136	70.6 Å²	70.6	60%	0.596	37%	0.365	S	S	*	.	H	α-helix	trans	-52.1	-28.2	170.7	-130.1	-86.7	0	0	0	113.5	D592 D639	D592-F594 PolarHBondContact O-N 3.04Å; F594-D639 HydrophobicContact CE2-CB 4.3Å; F594-D639 HydrophobicContact CZ-CB 4.09Å
595	K	47.2	Very low	62.6	Low	176 Å²	176	70.3 Å²	70.3	77%	0.765	36%	0.364	S	S	*	.	H	α-helix	trans	-78.4	-17.4	179.2	-68.5	-173.9	177.3	-178.2	0	115.3	N593 S598	N593-K595 PolarHBondContact O-N 3.2Å; K595-S598 PolarHBondContact O-OG 3.16Å
596	E	45.3	Very low	62.2	Low	75 Å²	75	70.2 Å²	70.2	35%	0.35	36%	0.363	S	S	.	.	H	α-helix	trans	-79.8	-31.6	175.7	-74.7	164.4	-172.2	0	0	110.7	S591 N593 S598 F599	S591-E596 PolarHBondContact OG-OE2 2.87Å; N593-E596 HydrophobicContact CB-CB 4.2Å; N593-E596 VanDerWaalsContact CB-CD 3.45Å; N593-E596 HydrophobicContact CB-CG 3.83Å; N593-E596 PolarHBondContact ND2-OE1 2.88Å; N593-E596 PolarHBondContact O-N 3.3Å; E596-S598 VanDerWaalsContact C-N 3.28Å; E596-S598 PolarHBondContact O-N 2.65Å; E596-F599 PolarHBondContact O-N 3.07Å; E596-F599 VanDerWaalsContact O-N 3.09Å
597	R	43.5	Very low	62	Low	70 Å²	70	69.5 Å²	69.5	26%	0.264	36%	0.36	S	S	.	.	H	α-helix	trans	-60.7	-33.2	179.3	-65.1	-174.7	179.4	-79.1	-12.7	113.3	F599 I600 S606	R597-F599 PolarHBondContact O-N 2.97Å; R597-I600 PolarHBondContact O-N 2.84Å; R597-I600 VanDerWaalsContact O-N 3.15Å; R597-S606 VanDerWaalsContact NH2-CA 3.33Å; R597-S606 PolarHBondContact NH2-O 3.03Å
598	S	34.8	Very low	62.1	Low	96 Å²	96	68.4 Å²	68.4	67%	0.671	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.6	-14	177.5	50	0	0	0	0	114.5	K595 E596	K595-S598 PolarHBondContact O-OG 3.16Å; E596-S598 VanDerWaalsContact C-N 3.28Å; E596-S598 PolarHBondContact O-N 2.65Å
599	F	35.4	Very low	62.1	Low	185 Å²	185	68.3 Å²	68.3	81%	0.811	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.6	-13.2	173.7	-70.9	-83	0	0	0	113.3	E596 R597	E596-F599 PolarHBondContact O-N 3.07Å; E596-F599 VanDerWaalsContact O-N 3.09Å; R597-F599 PolarHBondContact O-N 2.97Å
600	I	37.8	Very low	62.2	Low	107 Å²	107	68.4 Å²	68.4	55%	0.549	36%	0.359	S	S	.	.			trans	-102.4	89.9	178.4	-54.2	177.3	0	0	0	108.2	R597 N602	R597-I600 PolarHBondContact O-N 2.84Å; R597-I600 VanDerWaalsContact O-N 3.15Å; I600-N602 HydrophobicContact CG2-CB 4.26Å; I600-N602 PolarHBondContact O-N 3.47Å
601	A	40.1	Very low	62.5	Low	78 Å²	78	69.9 Å²	69.9	65%	0.645	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68	26.8	-171.3	0	0	0	0	0	116.2
602	N	54.2	Low	63.4	Low	76 Å²	76	69.7 Å²	69.7	41%	0.406	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.8	-7.2	-168.6	-64.3	-8.1	0	0	0	114	Y567 I600 L604	Y567-N602 PolarHBondContact OH-O 3.4Å; I600-N602 HydrophobicContact CG2-CB 4.26Å; I600-N602 PolarHBondContact O-N 3.47Å; N602-L604 HydrophobicContact CB-CD1 3.92Å; N602-L604 HydrophobicContact CB-CG 4.03Å; N602-L604 PolarHBondContact O-N 2.79Å
603	N	64.7	Low	64.2	Low	112 Å²	112	71.1 Å²	71.1	60%	0.599	37%	0.37	S	S	*	.			trans	53.5	22	-179.4	-72.1	-18.1	0	0	0	115.5	Y638	N603-Y638 PolarHBondContact O-OH 3.38Å
604	L	70.5	Confident	65.4	Low	39 Å²	39	72.2 Å²	72.2	20%	0.204	38%	0.382	C	S	.	.			trans	-69.1	149.8	-177.5	-70	164.1	0	0	0	112.2	N602 Y628 F663	N602-L604 HydrophobicContact CB-CD1 3.92Å; N602-L604 HydrophobicContact CB-CG 4.03Å; N602-L604 PolarHBondContact O-N 2.79Å; L604-Y628 HydrophobicContact CB-CE1 4.17Å; L604-F663 HydrophobicContact CD2-CD2 3.99Å; L604-F663 HydrophobicContact CD2-CE2 3.53Å; L604-F663 HydrophobicContact CD2-CZ 3.99Å
605	P	79	Confident	66.6	Low	4 Å²	4	71.6 Å²	71.6	3%	0.026	38%	0.384	C	S	.	.			trans	-61.8	167.8	-179.6	-20.3	32.1	0	0	0	113.8	Q607 Y628 I629 L630 Y638 I661	P605-Q607 PolarHBondContact O-N 2.92Å; P605-Y628 HydrophobicContact CB-CD1 4.34Å; P605-Y628 HydrophobicContact CG-CD1 4.4Å; P605-Y628 HydrophobicContact CG-CG 4.35Å; P605-I629 WeakPolarHBondContact CB-O 3.32Å; P605-L630 HydrophobicContact CB-CD2 4.01Å; P605-L630 HydrophobicContact CG-CD2 3.62Å; P605-Y638 HydrophobicContact CB-CD2 4.41Å; P605-Y638 HydrophobicContact CB-CE2 4.39Å; P605-Y638 HydrophobicContact CG-CD2 4.46Å; P605-Y638 HydrophobicContact CG-CE2 4Å; P605-I661 HydrophobicContact CG-CG2 4.19Å
606	S	78.2	Confident	68.4	Low	4 Å²	4	64 Å²	64	3%	0.028	35%	0.354	C	S	.	.	S	Bend	trans	-67.3	-38.3	-165.7	65.3	0	0	0	0	115.7	R597 V637 Y638 A640	R597-S606 VanDerWaalsContact NH2-CA 3.33Å; R597-S606 PolarHBondContact NH2-O 3.03Å; S606-V637 PolarHBondContact OG-O 3.33Å; S606-Y638 VanDerWaalsContact CB-O 3.22Å; S606-Y638 WeakPolarHBondContact CB-O 3.42Å; S606-Y638 PolarHBondContact N-O 2.91Å; S606-A640 WeakPolarHBondContact CB-O 3.46Å; S606-A640 PolarHBondContact OG-O 3.31Å
607	Q	85	Confident	70.2	Confident	1 Å²	1	64.2 Å²	64.2	1%	0.005	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	140.5	-175.4	-42.7	-55.6	-49.6	0	0	111.2	Q589 P605 Y628 I629 A640 H642 V645	Q589-Q607 WeakPolarHBondContact O-CA 3.41Å; P605-Q607 PolarHBondContact O-N 2.92Å; Q607-Y628 VanDerWaalsContact O-CA 3.27Å; Q607-Y628 WeakPolarHBondContact O-CA 3.34Å; Q607-Y628 WeakPolarHBondContact O-CD1 3.24Å; Q607-I629 HydrophobicContact CB-CB 4.49Å; Q607-I629 HydrophobicContact CB-CG1 4.5Å; Q607-I629 PolarHBondContact O-N 2.64Å; Q607-A640 PolarHBondContact NE2-O 3.13Å; Q607-H642 PolarHBondContact OE1-ND1 2.84Å; Q607-V645 HydrophobicContact CG-CB 3.95Å; Q607-V645 HydrophobicContact CG-CG1 3.76Å; Q607-V645 HydrophobicContact CG-CG2 3.77Å
608	S	88	Confident	72.3	Confident	24 Å²	24	60.9 Å²	60.9	17%	0.168	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	153.2	165.1	57.2	0	0	0	0	111.4	M588 Q589 D627	M588-S608 CarbonylContact C-O 3.33Å; M588-S608 VanDerWaalsContact CA-O 3.27Å; M588-S608 WeakPolarHBondContact CA-O 3.5Å; Q589-S608 PolarHBondContact N-O 3.03Å; Q589-S608 PolarHBondContact O-N 3.03Å; S608-D627 CarbonylContact C-O 3.48Å; S608-D627 WeakPolarHBondContact CA-O 3.29Å
609	I	89.3	Confident	74.8	Confident	3 Å²	3	60.7 Å²	60.7	2%	0.015	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	116.8	167.8	-54.4	-55.2	0	0	0	108	F586 M588 V612 L623 A624 G626 D627 I629	F586-I609 HydrophobicContact CD2-CD1 3.87Å; F586-I609 HydrophobicContact CE2-CD1 4.18Å; M588-I609 HydrophobicContact CG-CD1 4.1Å; I609-V612 HydrophobicContact CG2-CG2 3.64Å; I609-L623 HydrophobicContact CD1-CD1 4.14Å; I609-L623 HydrophobicContact CD1-CD2 4.08Å; I609-L623 HydrophobicContact CD1-CG 4.42Å; I609-L623 HydrophobicContact CG1-CD1 3.81Å; I609-L623 HydrophobicContact CG1-CD2 4.3Å; I609-L623 HydrophobicContact CG1-CG 4.12Å; I609-L623 HydrophobicContact CG2-CD2 4.44Å; I609-L623 HydrophobicContact CG2-CG 4.41Å; I609-A624 WeakPolarHBondContact CB-O 3.3Å; I609-G626 PolarHBondContact O-N 3.39Å; I609-D627 HydrophobicContact CB-CB 4.38Å; I609-D627 HydrophobicContact CG1-CB 3.87Å; I609-D627 PolarHBondContact N-O 3.14Å; I609-I629 HydrophobicContact CD1-CD1 3.99Å; I609-I629 HydrophobicContact CD1-CG1 4.13Å
610	L	86.9	Confident	77.2	Confident	88 Å²	88	59.2 Å²	59.2	46%	0.461	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	-41.6	180	179.9	62.2	0	0	0	111.3	I587 Q589	I587-L610 HydrophobicContact CG2-CD2 4.41Å; I587-L610 PolarHBondContact O-N 2.72Å; Q589-L610 HydrophobicContact CB-CB 4.35Å
611	S	85.1	Confident	79.4	Confident	44 Å²	44	55.9 Å²	55.9	31%	0.308	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.2	157.3	175.6	64.5	0	0	0	0	111.7	F586 I587	F586-S611 WeakPolarHBondContact CA-O 3.47Å; I587-S611 PolarHBondContact N-O 2.93Å; I587-S611 PolarHBondContact O-N 2.72Å
612	V	87.2	Confident	81.5	Confident	20 Å²	20	53.7 Å²	53.7	12%	0.121	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	139.4	174.1	-175.4	0	0	0	0	107.5	F586 I609 A618 E619 L623	F586-V612 HydrophobicContact CB-CG2 4.25Å; I609-V612 HydrophobicContact CG2-CG2 3.64Å; V612-A618 HydrophobicContact CG1-CB 3.76Å; V612-E619 HydrophobicContact CG1-CB 3.9Å; V612-L623 HydrophobicContact CG2-CB 4.45Å; V612-L623 HydrophobicContact CG2-CD2 4.32Å; V612-L623 HydrophobicContact CG2-CG 4.17Å
613	Q	84.2	Confident	83.2	Confident	78 Å²	78	50.4 Å²	50.4	36%	0.364	28%	0.278	S	S	.	.			trans	-73.6	127.6	178.5	-71.2	-178.9	-14.4	0	0	109.8	G585 S616	G585-Q613 WeakPolarHBondContact O-CB 3.48Å; G585-Q613 PolarHBondContact O-N 3.24Å; Q613-S616 WeakPolarHBondContact O-CB 3.47Å; Q613-S616 PolarHBondContact O-N 3.18Å; Q613-S616 PolarHBondContact O-OG 3.09Å
614	P	82.3	Confident	84.2	Confident	101 Å²	101	46.7 Å²	46.7	66%	0.656	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.2	143.9	176.2	-26.8	35.6	0	0	0	112.6	S616 E619	P614-S616 PolarHBondContact O-N 2.94Å; P614-S616 VanDerWaalsContact O-N 3.12Å; P614-E619 WeakPolarHBondContact CA-OE2 3.5Å
615	N	80.6	Confident	85	Confident	122 Å²	122	48.7 Å²	48.7	65%	0.652	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.6	4.5	-175.2	-66.6	-74.4	0	0	0	116.4	E619 K620	N615-E619 WeakPolarHBondContact CA-OE2 3.37Å; N615-E619 PolarHBondContact N-OE2 3.2Å; N615-K620 WeakPolarHBondContact O-CE 3.39Å; N615-K620 PolarHBondContact O-NZ 3.16Å
616	S	84.8	Confident	85.2	Confident	18 Å²	18	50.2 Å²	50.2	13%	0.126	30%	0.295	C	S	.	.	S	Bend	trans	-70.1	169	-179.2	70.5	0	0	0	0	113.6	Q613 P614 A618 E619 K620	Q613-S616 WeakPolarHBondContact O-CB 3.47Å; Q613-S616 PolarHBondContact O-N 3.18Å; Q613-S616 PolarHBondContact O-OG 3.09Å; P614-S616 PolarHBondContact O-N 2.94Å; P614-S616 VanDerWaalsContact O-N 3.12Å; S616-A618 PolarHBondContact O-N 3Å; S616-A618 PolarHBondContact OG-N 3.23Å; S616-E619 PolarHBondContact O-N 3.25Å; S616-E619 PolarHBondContact OG-N 2.86Å; S616-K620 WeakPolarHBondContact O-CB 3.34Å; S616-K620 WeakPolarHBondContact O-CG 3.25Å; S616-K620 PolarHBondContact O-N 3.16Å
617	K	83.3	Confident	85.8	Confident	78 Å²	78	50 Å²	50	34%	0.339	29%	0.294	S	S	.	.	H	α-helix	trans	-62	-30.4	171.5	-66	-175.4	178.4	-172	0	112	E578 R579 A621	E578-K617 HydrophobicContact CB-CD 4.25Å; E578-K617 WeakPolarHBondContact O-CD 3.33Å; E578-K617 IonicContact OE1-NZ 2.7Å; E578-K617 PolarHBondContact OE1-NZ 2.91Å; E578-K617 IonicContact OE2-NZ 2.79Å; E578-K617 PolarHBondContact OE2-NZ 3.16Å; R579-K617 PolarHBondContact O-NZ 2.91Å; K617-A621 WeakPolarHBondContact O-CB 3.39Å; K617-A621 PolarHBondContact O-N 3Å; K617-A621 VanDerWaalsContact O-N 3.11Å
618	A	87.8	Confident	86.1	Confident	0 Å²	0	52.6 Å²	52.6	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-68.2	-48.4	176.9	0	0	0	0	0	113.4	L577 Y584 F586 V612 S616 K620 A621 G622 L623	L577-A618 HydrophobicContact CD1-CB 4.35Å; L577-A618 HydrophobicContact CD2-CB 4.41Å; Y584-A618 WeakPolarHBondContact O-CB 3.39Å; F586-A618 HydrophobicContact CB-CB 4.37Å; F586-A618 HydrophobicContact CD1-CB 4Å; V612-A618 HydrophobicContact CG1-CB 3.76Å; S616-A618 PolarHBondContact O-N 3Å; S616-A618 PolarHBondContact OG-N 3.23Å; A618-K620 VanDerWaalsContact C-N 3.35Å; A618-K620 PolarHBondContact O-N 2.85Å; A618-A621 PolarHBondContact O-N 3.27Å; A618-G622 PolarHBondContact O-N 2.89Å; A618-L623 HydrophobicContact CB-CB 4.27Å; A618-L623 HydrophobicContact CB-CD2 4.02Å; A618-L623 WeakPolarHBondContact O-CB 3.4Å; A618-L623 PolarHBondContact O-N 3.4Å
619	E	86.7	Confident	86.1	Confident	92 Å²	92	51.4 Å²	51.4	43%	0.43	30%	0.296	S	S	.	.	H	α-helix	trans	-62.5	-44.2	177.1	-172.5	178.6	-120.5	0	0	110.7	V612 P614 N615 S616 A621 G622	V612-E619 HydrophobicContact CG1-CB 3.9Å; P614-E619 WeakPolarHBondContact CA-OE2 3.5Å; N615-E619 WeakPolarHBondContact CA-OE2 3.37Å; N615-E619 PolarHBondContact N-OE2 3.2Å; S616-E619 PolarHBondContact O-N 3.25Å; S616-E619 PolarHBondContact OG-N 2.86Å; E619-A621 PolarHBondContact O-N 3.18Å; E619-G622 PolarHBondContact O-N 3.24Å
620	K	84.6	Confident	86.1	Confident	155 Å²	155	51.3 Å²	51.3	67%	0.674	30%	0.295	S	S	*	.	H	α-helix	trans	-65.2	-21.6	177.6	-72.4	169.4	176.6	157.8	0	114.3	N615 S616 A618 G622	N615-K620 WeakPolarHBondContact O-CE 3.39Å; N615-K620 PolarHBondContact O-NZ 3.16Å; S616-K620 WeakPolarHBondContact O-CB 3.34Å; S616-K620 WeakPolarHBondContact O-CG 3.25Å; S616-K620 PolarHBondContact O-N 3.16Å; A618-K620 VanDerWaalsContact C-N 3.35Å; A618-K620 PolarHBondContact O-N 2.85Å; K620-G622 VanDerWaalsContact C-N 3.35Å
621	A	85.5	Confident	86.3	Confident	36 Å²	36	48.7 Å²	48.7	30%	0.298	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.2	0.2	172.1	0	0	0	0	0	113.4	I575 L577 K617 A618 E619	I575-A621 HydrophobicContact CB-CB 4.41Å; I575-A621 HydrophobicContact CD1-CB 4.49Å; I575-A621 VanDerWaalsContact CG2-O 3.26Å; I575-A621 WeakPolarHBondContact CG2-O 3.34Å; L577-A621 HydrophobicContact CD2-CB 3.4Å; L577-A621 VanDerWaalsContact CD2-CB 3.4Å; K617-A621 WeakPolarHBondContact O-CB 3.39Å; K617-A621 PolarHBondContact O-N 3Å; K617-A621 VanDerWaalsContact O-N 3.11Å; A618-A621 PolarHBondContact O-N 3.27Å; E619-A621 PolarHBondContact O-N 3.18Å
622	G	83.9	Confident	86.5	Confident	33 Å²	33	46.7 Å²	46.7	34%	0.34	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	79.3	31.2	179.7	0	0	0	0	0	114.4	R573 A618 E619 K620	R573-G622 PolarHBondContact NE-O 2.97Å; R573-G622 VanDerWaalsContact NE-O 3.13Å; R573-G622 PolarHBondContact NH2-O 3.25Å; A618-G622 PolarHBondContact O-N 2.89Å; E619-G622 PolarHBondContact O-N 3.24Å; K620-G622 VanDerWaalsContact C-N 3.35Å
623	L	89.2	Confident	86.6	Confident	6 Å²	6	49.1 Å²	49.1	3%	0.031	28%	0.279	C	S	.	.			trans	-83	136.9	163.4	-166	68.3	0	0	0	109.6	I575 F586 I609 V612 A618 D627 I660	I575-L623 HydrophobicContact CD1-CB 3.82Å; I575-L623 HydrophobicContact CD1-CD1 3.82Å; I575-L623 HydrophobicContact CD1-CG 4.28Å; F586-L623 HydrophobicContact CB-CD2 3.71Å; F586-L623 HydrophobicContact CD1-CD2 3.54Å; F586-L623 HydrophobicContact CD2-CD2 4.12Å; F586-L623 HydrophobicContact CE1-CD2 4.16Å; F586-L623 HydrophobicContact CG-CD2 3.52Å; I609-L623 HydrophobicContact CD1-CD1 4.14Å; I609-L623 HydrophobicContact CD1-CD2 4.08Å; I609-L623 HydrophobicContact CD1-CG 4.42Å; I609-L623 HydrophobicContact CG1-CD1 3.81Å; I609-L623 HydrophobicContact CG1-CD2 4.3Å; I609-L623 HydrophobicContact CG1-CG 4.12Å; I609-L623 HydrophobicContact CG2-CD2 4.44Å; I609-L623 HydrophobicContact CG2-CG 4.41Å; V612-L623 HydrophobicContact CG2-CB 4.45Å; V612-L623 HydrophobicContact CG2-CD2 4.32Å; V612-L623 HydrophobicContact CG2-CG 4.17Å; A618-L623 HydrophobicContact CB-CB 4.27Å; A618-L623 HydrophobicContact CB-CD2 4.02Å; A618-L623 WeakPolarHBondContact O-CB 3.4Å; A618-L623 PolarHBondContact O-N 3.4Å; L623-D627 HydrophobicContact CD1-CB 4.37Å; L623-I660 HydrophobicContact CD1-CD1 3.6Å; L623-I660 HydrophobicContact CD1-CG2 4.08Å
624	A	86.4	Confident	86.6	Confident	34 Å²	34	48.1 Å²	48.1	28%	0.281	29%	0.289	S	S	.	.			trans	-135.6	154	-177.3	0	0	0	0	0	112.2	I609 G626 D627	I609-A624 WeakPolarHBondContact CB-O 3.3Å; A624-G626 PolarHBondContact O-N 3.22Å; A624-D627 PolarHBondContact N-OD2 3.07Å; A624-D627 WeakPolarHBondContact O-CB 3.3Å; A624-D627 PolarHBondContact O-N 3.25Å
625	P	86.1	Confident	86.8	Confident	82 Å²	82	47.5 Å²	47.5	53%	0.532	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.8	137.9	168	-22.1	33.4	0	0	0	111.3	D627	P625-D627 VanDerWaalsContact C-N 3.35Å
626	G	85	Confident	87	Confident	36 Å²	36	44.1 Å²	44.1	37%	0.371	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	84.3	-2.8	-176.6	0	0	0	0	0	115.7	I609 A624 Y628	I609-G626 PolarHBondContact O-N 3.39Å; A624-G626 PolarHBondContact O-N 3.22Å; G626-Y628 WeakPolarHBondContact O-CD2 3.43Å
627	D	90.2	Very high	87.1	Confident	0 Å²	0	43.4 Å²	43.4	0%	0	26%	0.256	C	S	.	.			trans	-64.7	146.5	161.6	-71.7	-37.1	0	0	0	110.6	R573 S608 I609 L623 A624 P625 I660 N662	R573-D627 IonicContact CZ-OD1 2.67Å; R573-D627 IonicContact CZ-OD2 3.92Å; R573-D627 IonicContact NH1-OD1 2.64Å; R573-D627 PolarHBondContact NH1-OD1 2.96Å; R573-D627 IonicContact NH2-OD1 3.66Å; R573-D627 PolarHBondContact NH2-OD1 3.14Å; R573-D627 IonicContact NH2-OD2 3.49Å; R573-D627 PolarHBondContact NH2-OD2 3.21Å; S608-D627 CarbonylContact C-O 3.48Å; S608-D627 WeakPolarHBondContact CA-O 3.29Å; I609-D627 HydrophobicContact CB-CB 4.38Å; I609-D627 HydrophobicContact CG1-CB 3.87Å; I609-D627 PolarHBondContact N-O 3.14Å; L623-D627 HydrophobicContact CD1-CB 4.37Å; A624-D627 PolarHBondContact N-OD2 3.07Å; A624-D627 WeakPolarHBondContact O-CB 3.3Å; A624-D627 PolarHBondContact O-N 3.25Å; P625-D627 VanDerWaalsContact C-N 3.35Å; D627-I660 HydrophobicContact CB-CB 4.42Å; D627-N662 VanDerWaalsContact OD1-CB 3.27Å; D627-N662 WeakPolarHBondContact OD1-CB 3.42Å; D627-N662 PolarHBondContact OD1-ND2 3.46Å
628	Y	90	Very high	87.2	Confident	54 Å²	54	40.5 Å²	40.5	21%	0.212	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	142.3	171.6	-72.1	-99.2	0	0	0	110.9	L604 P605 Q607 G626 I660 I661 F663	L604-Y628 HydrophobicContact CB-CE1 4.17Å; P605-Y628 HydrophobicContact CB-CD1 4.34Å; P605-Y628 HydrophobicContact CG-CD1 4.4Å; P605-Y628 HydrophobicContact CG-CG 4.35Å; Q607-Y628 VanDerWaalsContact O-CA 3.27Å; Q607-Y628 WeakPolarHBondContact O-CA 3.34Å; Q607-Y628 WeakPolarHBondContact O-CD1 3.24Å; G626-Y628 WeakPolarHBondContact O-CD2 3.43Å; Y628-I660 CarbonylContact O-C 3.58Å; Y628-I660 WeakPolarHBondContact O-CA 3.24Å; Y628-I661 PolarHBondContact N-O 3.32Å; Y628-I661 PolarHBondContact O-N 2.99Å; Y628-F663 AromaticContact CD2-CD2 3.74Å; Y628-F663 HydrophobicContact CD2-CD2 3.74Å; Y628-F663 AromaticContact CD2-CE2 3.72Å; Y628-F663 HydrophobicContact CD2-CE2 3.72Å; Y628-F663 AromaticContact CE2-CD2 3.84Å; Y628-F663 HydrophobicContact CE2-CD2 3.84Å; Y628-F663 HydrophobicContact CE2-CE2 4.09Å; Y628-F663 HydrophobicContact CG-CE2 4.28Å
629	I	90	Very high	87	Confident	0 Å²	0	42.9 Å²	42.9	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	137.3	179.7	-49.8	-176.6	0	0	0	110.9	M588 P605 Q607 I609 I632 V637 L658 I660	M588-I629 HydrophobicContact CG-CD1 4.38Å; M588-I629 HydrophobicContact SD-CD1 3.48Å; M588-I629 WeakPolarHBondContact SD-CD1 3.38Å; P605-I629 WeakPolarHBondContact CB-O 3.32Å; Q607-I629 HydrophobicContact CB-CB 4.49Å; Q607-I629 HydrophobicContact CB-CG1 4.5Å; Q607-I629 PolarHBondContact O-N 2.64Å; I609-I629 HydrophobicContact CD1-CD1 3.99Å; I609-I629 HydrophobicContact CD1-CG1 4.13Å; I629-I632 HydrophobicContact CG2-CD1 4.16Å; I629-I632 HydrophobicContact CG2-CG1 3.81Å; I629-V637 HydrophobicContact CB-CG2 4.47Å; I629-V637 HydrophobicContact CG2-CG2 3.79Å; I629-L658 HydrophobicContact CD1-CD1 4.48Å; I629-L658 HydrophobicContact CG2-CD2 4.36Å; I629-I660 HydrophobicContact CG1-CG2 4.39Å
630	L	88.9	Confident	86.8	Confident	0 Å²	0	39.4 Å²	39.4	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	-46.6	-177.9	-69.9	175.5	0	0	0	113.1	F556 L572 P605 V637 Y638 K659 I661	F556-L630 HydrophobicContact CE2-CB 3.86Å; F556-L630 HydrophobicContact CE2-CD1 4.06Å; F556-L630 HydrophobicContact CE2-CD2 4.31Å; F556-L630 HydrophobicContact CE2-CG 4.32Å; F556-L630 HydrophobicContact CZ-CB 4.47Å; F556-L630 HydrophobicContact CZ-CD1 4.25Å; L572-L630 HydrophobicContact CD1-CD1 3.43Å; L572-L630 VanDerWaalsContact CD1-CD1 3.43Å; P605-L630 HydrophobicContact CB-CD2 4.01Å; P605-L630 HydrophobicContact CG-CD2 3.62Å; L630-V637 WeakPolarHBondContact O-CG2 3.45Å; L630-V637 PolarHBondContact O-N 2.81Å; L630-Y638 HydrophobicContact CD2-CD2 3.6Å; L630-Y638 HydrophobicContact CD2-CE2 3.72Å; L630-K659 HydrophobicContact CB-CB 4.49Å; L630-K659 WeakPolarHBondContact CB-O 3.32Å; L630-K659 PolarHBondContact N-O 3.23Å; L630-I661 HydrophobicContact CD1-CB 3.8Å; L630-I661 HydrophobicContact CD1-CG2 3.72Å; L630-I661 HydrophobicContact CD2-CG2 4.1Å; L630-I661 HydrophobicContact CG-CB 4.42Å; L630-I661 HydrophobicContact CG-CG2 3.84Å
631	E	90.6	Very high	86.8	Confident	34 Å²	34	33.5 Å²	33.5	16%	0.159	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	147	175.4	-64.7	169.1	-160.8	0	0	110.9	F556 I635 K659	F556-E631 WeakPolarHBondContact CD1-OE1 3.45Å; F556-E631 HydrophobicContact CD2-CG 4.49Å; F556-E631 WeakPolarHBondContact CE1-OE1 3.4Å; F556-E631 HydrophobicContact CE2-CG 4.49Å; F556-E631 WeakPolarHBondContact CG-OE1 3.38Å; E631-I635 CarbonylContact C-O 3.57Å; E631-I635 WeakPolarHBondContact CA-O 3.42Å; E631-K659 HydrophobicContact CB-CB 3.75Å; E631-K659 HydrophobicContact CB-CD 4.03Å; E631-K659 HydrophobicContact CG-CB 4.39Å; E631-K659 HydrophobicContact CG-CD 3.84Å; E631-K659 PolarHBondContact N-O 3.5Å; E631-K659 PolarHBondContact O-N 2.95Å; E631-K659 WeakPolarHBondContact OE1-CD 3.46Å; E631-K659 IonicContact OE1-NZ 3.27Å; E631-K659 PolarHBondContact OE1-NZ 3.24Å; E631-K659 WeakPolarHBondContact OE2-CD 3.2Å; E631-K659 IonicContact OE2-NZ 2.72Å; E631-K659 PolarHBondContact OE2-NZ 3.23Å
632	I	89.9	Confident	86.8	Confident	2 Å²	2	32 Å²	32	1%	0.01	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	117.5	173.5	-60.6	-173.4	0	0	0	108.4	I629 G634 I635 V637 V645 L648 I649 L656 Q657 L658	I629-I632 HydrophobicContact CG2-CD1 4.16Å; I629-I632 HydrophobicContact CG2-CG1 3.81Å; I632-G634 PolarHBondContact O-N 3.31Å; I632-G634 VanDerWaalsContact O-N 3.07Å; I632-I635 PolarHBondContact N-O 2.96Å; I632-I635 WeakPolarHBondContact O-CB 3.1Å; I632-I635 PolarHBondContact O-N 2.96Å; I632-V637 HydrophobicContact CB-CG1 4.23Å; I632-V637 HydrophobicContact CD1-CG1 4.13Å; I632-V637 HydrophobicContact CD1-CG2 4.27Å; I632-V637 HydrophobicContact CG1-CG1 4.01Å; I632-V637 HydrophobicContact CG1-CG2 3.97Å; I632-V645 HydrophobicContact CD1-CB 4.49Å; I632-V645 HydrophobicContact CD1-CG1 3.48Å; I632-V645 VanDerWaalsContact CD1-CG1 3.48Å; I632-L648 HydrophobicContact CG2-CB 4.38Å; I632-I649 HydrophobicContact CD1-CD1 4.04Å; I632-I649 HydrophobicContact CD1-CG1 3.91Å; I632-L656 HydrophobicContact CG2-CD1 3.68Å; I632-Q657 WeakPolarHBondContact CA-O 3.21Å; I632-L658 HydrophobicContact CB-CD2 4.49Å; I632-L658 HydrophobicContact CD1-CD2 4.24Å; I632-L658 HydrophobicContact CG1-CD2 3.79Å; I632-L658 HydrophobicContact CG2-CD2 4.42Å
633	N	88.6	Confident	86.8	Confident	71 Å²	71	36.4 Å²	36.4	38%	0.38	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	46.5	36.8	-174.2	-71	18.6	0	0	0	113.6	T652 Q657	N633-T652 VanDerWaalsContact ND2-CG2 3.25Å; N633-T652 WeakPolarHBondContact ND2-CG2 3.44Å; N633-Q657 PolarHBondContact N-O 3.05Å; N633-Q657 PolarHBondContact OD1-N 3.33Å; N633-Q657 PolarHBondContact OD1-O 3.35Å
634	G	83.7	Confident	86.6	Confident	57 Å²	57	41 Å²	41	59%	0.588	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	84.7	0.5	-178.8	0	0	0	0	0	115.8	I632	I632-G634 PolarHBondContact O-N 3.31Å; I632-G634 VanDerWaalsContact O-N 3.07Å
635	I	86.9	Confident	86.8	Confident	87 Å²	87	39.4 Å²	39.4	45%	0.446	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	123.3	174.7	-58	170.6	0	0	0	109	E631 I632 V637 L648	E631-I635 CarbonylContact C-O 3.57Å; E631-I635 WeakPolarHBondContact CA-O 3.42Å; I632-I635 PolarHBondContact N-O 2.96Å; I632-I635 WeakPolarHBondContact O-CB 3.1Å; I632-I635 PolarHBondContact O-N 2.96Å; I635-V637 PolarHBondContact O-N 2.98Å; I635-L648 HydrophobicContact CD1-CD2 3.72Å; I635-L648 HydrophobicContact CG2-CD1 4.37Å
636	D	85	Confident	86.9	Confident	52 Å²	52	36.7 Å²	36.7	28%	0.278	21%	0.206	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.7	115.1	173.4	179.6	-8.3	0	0	0	110.2	F556 Y638	F556-D636 PolarHBondContact N-OD2 3.17Å; D636-Y638 WeakPolarHBondContact OD1-CB 3.3Å; D636-Y638 PolarHBondContact OD1-N 3.4Å
637	V	87.6	Confident	87	Confident	2 Å²	2	38.3 Å²	38.3	1%	0.012	21%	0.206	C	C	.	.			trans	-109	13.7	-178.7	-64.8	0	0	0	0	113.1	S606 I629 L630 I632 I635 D639 A640 V645 L648	S606-V637 PolarHBondContact OG-O 3.33Å; I629-V637 HydrophobicContact CB-CG2 4.47Å; I629-V637 HydrophobicContact CG2-CG2 3.79Å; L630-V637 WeakPolarHBondContact O-CG2 3.45Å; L630-V637 PolarHBondContact O-N 2.81Å; I632-V637 HydrophobicContact CB-CG1 4.23Å; I632-V637 HydrophobicContact CD1-CG1 4.13Å; I632-V637 HydrophobicContact CD1-CG2 4.27Å; I632-V637 HydrophobicContact CG1-CG1 4.01Å; I632-V637 HydrophobicContact CG1-CG2 3.97Å; I635-V637 PolarHBondContact O-N 2.98Å; V637-D639 VanDerWaalsContact C-N 3.28Å; V637-D639 PolarHBondContact O-N 3.08Å; V637-D639 VanDerWaalsContact O-N 3.13Å; V637-A640 HydrophobicContact CB-CB 3.99Å; V637-A640 HydrophobicContact CG1-CB 4.4Å; V637-A640 WeakPolarHBondContact O-CB 3.19Å; V637-A640 PolarHBondContact O-N 3.2Å; V637-V645 HydrophobicContact CB-CG2 3.95Å; V637-V645 HydrophobicContact CG1-CG2 4.17Å; V637-L648 HydrophobicContact CG1-CD1 3.65Å
638	Y	85.7	Confident	86.9	Confident	17 Å²	17	40.5 Å²	40.5	7%	0.067	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.6	-39.3	-171.1	-160.4	-75.2	0	0	0	114.6	R559 I563 N603 P605 S606 L630 D636	R559-Y638 HydrophobicContact CB-CD2 4.35Å; R559-Y638 HydrophobicContact CB-CE2 4.09Å; I563-Y638 HydrophobicContact CD1-CE2 3.67Å; I563-Y638 WeakPolarHBondContact CD1-OH 3.48Å; N603-Y638 PolarHBondContact O-OH 3.38Å; P605-Y638 HydrophobicContact CB-CD2 4.41Å; P605-Y638 HydrophobicContact CB-CE2 4.39Å; P605-Y638 HydrophobicContact CG-CD2 4.46Å; P605-Y638 HydrophobicContact CG-CE2 4Å; S606-Y638 VanDerWaalsContact CB-O 3.22Å; S606-Y638 WeakPolarHBondContact CB-O 3.42Å; S606-Y638 PolarHBondContact N-O 2.91Å; L630-Y638 HydrophobicContact CD2-CD2 3.6Å; L630-Y638 HydrophobicContact CD2-CE2 3.72Å; D636-Y638 WeakPolarHBondContact OD1-CB 3.3Å; D636-Y638 PolarHBondContact OD1-N 3.4Å
639	D	82.1	Confident	86.9	Confident	51 Å²	51	38 Å²	38	27%	0.273	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102.8	-7	178	-56.8	-35.2	0	0	0	113.4	R559 F594 V637	R559-D639 IonicContact CZ-OD1 2.7Å; R559-D639 VanDerWaalsContact CZ-OD1 3.27Å; R559-D639 IonicContact CZ-OD2 3.24Å; R559-D639 IonicContact NH1-OD1 3.3Å; R559-D639 PolarHBondContact NH1-OD1 2.94Å; R559-D639 IonicContact NH1-OD2 3.15Å; R559-D639 PolarHBondContact NH1-OD2 3.03Å; R559-D639 IonicContact NH2-OD1 3.67Å; R559-D639 PolarHBondContact NH2-OD1 3.11Å; R559-D639 IonicContact NH2-OD2 2.69Å; R559-D639 PolarHBondContact NH2-OD2 3.44Å; F594-D639 HydrophobicContact CE2-CB 4.3Å; F594-D639 HydrophobicContact CZ-CB 4.09Å; V637-D639 VanDerWaalsContact C-N 3.28Å; V637-D639 PolarHBondContact O-N 3.08Å; V637-D639 VanDerWaalsContact O-N 3.13Å
640	A	82.9	Confident	86.7	Confident	18 Å²	18	41 Å²	41	15%	0.149	23%	0.226	C	C	.	.			trans	-61.7	140.1	-168.4	0	0	0	0	0	111.7	S606 Q607 V637 E644 V645	S606-A640 WeakPolarHBondContact CB-O 3.46Å; S606-A640 PolarHBondContact OG-O 3.31Å; Q607-A640 PolarHBondContact NE2-O 3.13Å; V637-A640 HydrophobicContact CB-CB 3.99Å; V637-A640 HydrophobicContact CG1-CB 4.4Å; V637-A640 WeakPolarHBondContact O-CB 3.19Å; V637-A640 PolarHBondContact O-N 3.2Å; A640-E644 HydrophobicContact CB-CB 4.21Å; A640-V645 HydrophobicContact CB-CG2 3.7Å
641	T	83.9	Confident	86.5	Confident	31 Å²	31	46.1 Å²	46.1	19%	0.19	26%	0.258	C	S	.	.			trans	-61.2	158	175.7	58.2	0	0	0	0	111	K643 E644 V645	T641-K643 PolarHBondContact O-N 3.07Å; T641-E644 WeakPolarHBondContact CB-OE2 3.13Å; T641-E644 WeakPolarHBondContact CG2-OE2 3.46Å; T641-E644 PolarHBondContact N-OE2 3.33Å; T641-E644 PolarHBondContact O-N 3.05Å; T641-E644 VanDerWaalsContact O-N 3.16Å; T641-E644 VanDerWaalsContact OG1-CD 3.28Å; T641-E644 VanDerWaalsContact OG1-CG 3.25Å; T641-E644 WeakPolarHBondContact OG1-CG 3.25Å; T641-E644 PolarHBondContact OG1-N 3.34Å; T641-E644 PolarHBondContact OG1-OE2 3.37Å; T641-V645 PolarHBondContact O-N 3.01Å; T641-V645 VanDerWaalsContact O-N 3.14Å
642	H	86.1	Confident	86.1	Confident	4 Å²	4	45.4 Å²	45.4	2%	0.019	26%	0.256	C	S	.	.	H	α-helix	trans	-58.2	-39.4	176.8	-174	71.3	0	0	0	110.5	D592 Q607 V645 V646 Q822 A824	D592-H642 WeakPolarHBondContact OD1-CB 3.35Å; D592-H642 PolarHBondContact OD1-N 2.99Å; Q607-H642 PolarHBondContact OE1-ND1 2.84Å; H642-V645 PolarHBondContact O-N 3.32Å; H642-V646 WeakPolarHBondContact O-CG2 3.27Å; H642-V646 PolarHBondContact O-N 3.23Å; H642-Q822 PolarHBondContact CD2-O 3.48Å; H642-Q822 PolarHBondContact NE2-O 3.44Å; H642-Q822 VanDerWaalsContact NE2-O 3.15Å; H642-A824 VanDerWaalsContact NE2-CB 3.32Å; H642-A824 WeakPolarHBondContact NE2-CB 3.42Å
643	K	84.1	Confident	85.5	Confident	127 Å²	127	52.3 Å²	52.3	55%	0.552	29%	0.286	S	S	*	.	H	α-helix	trans	-56.6	-53.2	171.6	-163.2	-164.1	173.9	-149.1	0	113.6	D592 T641 V645 V646 D647	D592-K643 PolarHBondContact OD1-N 3.14Å; T641-K643 PolarHBondContact O-N 3.07Å; K643-V645 PolarHBondContact O-N 3.16Å; K643-V646 PolarHBondContact O-N 2.87Å; K643-V646 VanDerWaalsContact O-N 3.13Å; K643-D647 WeakPolarHBondContact CE-OD2 3.45Å; K643-D647 IonicContact NZ-OD2 3.19Å; K643-D647 PolarHBondContact NZ-OD2 3.29Å; K643-D647 WeakPolarHBondContact O-CB 3.44Å; K643-D647 PolarHBondContact O-N 3.4Å
644	E	85.8	Confident	85.1	Confident	102 Å²	102	54.8 Å²	54.8	48%	0.477	30%	0.299	S	S	.	.	H	α-helix	trans	-58.7	-36.2	-178.5	-75.2	161.8	129.4	0	0	112.4	A640 T641 L648	A640-E644 HydrophobicContact CB-CB 4.21Å; T641-E644 WeakPolarHBondContact CB-OE2 3.13Å; T641-E644 WeakPolarHBondContact CG2-OE2 3.46Å; T641-E644 PolarHBondContact N-OE2 3.33Å; T641-E644 PolarHBondContact O-N 3.05Å; T641-E644 VanDerWaalsContact O-N 3.16Å; T641-E644 VanDerWaalsContact OG1-CD 3.28Å; T641-E644 VanDerWaalsContact OG1-CG 3.25Å; T641-E644 WeakPolarHBondContact OG1-CG 3.25Å; T641-E644 PolarHBondContact OG1-N 3.34Å; T641-E644 PolarHBondContact OG1-OE2 3.37Å; E644-L648 WeakPolarHBondContact O-CB 3.46Å; E644-L648 VanDerWaalsContact O-CG 3.3Å; E644-L648 WeakPolarHBondContact O-CG 3.43Å; E644-L648 PolarHBondContact O-N 3.27Å
645	V	89.1	Confident	85.2	Confident	0 Å²	0	56.8 Å²	56.8	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-72.3	-37.6	177.4	175.2	0	0	0	0	112.1	M588 Q607 I632 V637 A640 T641 H642 K643 L648 I649	M588-V645 HydrophobicContact CE-CG1 3.99Å; M588-V645 HydrophobicContact SD-CG1 4.08Å; Q607-V645 HydrophobicContact CG-CB 3.95Å; Q607-V645 HydrophobicContact CG-CG1 3.76Å; Q607-V645 HydrophobicContact CG-CG2 3.77Å; I632-V645 HydrophobicContact CD1-CB 4.49Å; I632-V645 HydrophobicContact CD1-CG1 3.48Å; I632-V645 VanDerWaalsContact CD1-CG1 3.48Å; V637-V645 HydrophobicContact CB-CG2 3.95Å; V637-V645 HydrophobicContact CG1-CG2 4.17Å; A640-V645 HydrophobicContact CB-CG2 3.7Å; T641-V645 PolarHBondContact O-N 3.01Å; T641-V645 VanDerWaalsContact O-N 3.14Å; H642-V645 PolarHBondContact O-N 3.32Å; K643-V645 PolarHBondContact O-N 3.16Å; V645-L648 PolarHBondContact O-N 2.8Å; V645-I649 HydrophobicContact CG1-CD1 4.12Å; V645-I649 WeakPolarHBondContact O-CG1 3.48Å; V645-I649 PolarHBondContact O-N 2.88Å
646	V	88.7	Confident	85.4	Confident	25 Å²	25	52.7 Å²	52.7	15%	0.152	27%	0.273	C	S	.	.	H	α-helix	trans	-66.7	-42.4	172.1	170.4	0	0	0	0	111.5	M588 H642 K643 L648 I649 T650 A824 L826	M588-V646 HydrophobicContact CE-CG2 4.04Å; H642-V646 WeakPolarHBondContact O-CG2 3.27Å; H642-V646 PolarHBondContact O-N 3.23Å; K643-V646 PolarHBondContact O-N 2.87Å; K643-V646 VanDerWaalsContact O-N 3.13Å; V646-L648 VanDerWaalsContact C-N 3.31Å; V646-L648 PolarHBondContact O-N 3.05Å; V646-I649 PolarHBondContact O-N 2.69Å; V646-T650 HydrophobicContact CG1-CG2 4.23Å; V646-T650 WeakPolarHBondContact O-CB 3.46Å; V646-T650 VanDerWaalsContact O-CG2 3.32Å; V646-T650 WeakPolarHBondContact O-CG2 3.42Å; V646-T650 PolarHBondContact O-N 3.41Å; V646-T650 PolarHBondContact O-OG1 2.96Å; V646-A824 HydrophobicContact CG2-CB 3.74Å; V646-L826 HydrophobicContact CG1-CD2 4.35Å
647	D	86.8	Confident	85.7	Confident	70 Å²	70	54.7 Å²	54.7	37%	0.374	28%	0.281	S	S	.	.	H	α-helix	trans	-62.2	-37.9	176.4	-71.1	-12.8	0	0	0	110.8	K643 T650 T651	K643-D647 WeakPolarHBondContact CE-OD2 3.45Å; K643-D647 IonicContact NZ-OD2 3.19Å; K643-D647 PolarHBondContact NZ-OD2 3.29Å; K643-D647 WeakPolarHBondContact O-CB 3.44Å; K643-D647 PolarHBondContact O-N 3.4Å; D647-T650 WeakPolarHBondContact CA-OG1 3.43Å; D647-T650 PolarHBondContact O-OG1 2.77Å; D647-T651 WeakPolarHBondContact O-CB 3.44Å; D647-T651 PolarHBondContact O-N 3.39Å; D647-T651 VanDerWaalsContact O-N 3.14Å; D647-T651 PolarHBondContact O-OG1 3.1Å
648	L	89.5	Confident	85.9	Confident	47 Å²	47	54.6 Å²	54.6	25%	0.246	28%	0.281	C	S	.	.	H	α-helix	trans	-64.4	-49.4	172.5	-76.5	171.2	0	0	0	113	I632 I635 V637 E644 V645 V646 T651 T652	I632-L648 HydrophobicContact CG2-CB 4.38Å; I635-L648 HydrophobicContact CD1-CD2 3.72Å; I635-L648 HydrophobicContact CG2-CD1 4.37Å; V637-L648 HydrophobicContact CG1-CD1 3.65Å; E644-L648 WeakPolarHBondContact O-CB 3.46Å; E644-L648 VanDerWaalsContact O-CG 3.3Å; E644-L648 WeakPolarHBondContact O-CG 3.43Å; E644-L648 PolarHBondContact O-N 3.27Å; V645-L648 PolarHBondContact O-N 2.8Å; V646-L648 VanDerWaalsContact C-N 3.31Å; V646-L648 PolarHBondContact O-N 3.05Å; L648-T651 PolarHBondContact O-N 3.16Å; L648-T652 PolarHBondContact O-N 2.95Å
649	I	89.3	Confident	86.1	Confident	1 Å²	1	56 Å²	56	1%	0.005	29%	0.287	C	S	.	.	H	α-helix	trans	-68.3	-35.4	-177.6	-68.1	173.1	0	0	0	112	Y584 F586 M588 I632 V645 V646 T651 T652 L656 L826	Y584-I649 HydrophobicContact CD2-CG2 3.99Å; Y584-I649 HydrophobicContact CE2-CG2 4.05Å; F586-I649 HydrophobicContact CE2-CD1 4.5Å; F586-I649 HydrophobicContact CZ-CD1 4.32Å; M588-I649 HydrophobicContact CE-CD1 3.67Å; M588-I649 HydrophobicContact SD-CD1 3.73Å; I632-I649 HydrophobicContact CD1-CD1 4.04Å; I632-I649 HydrophobicContact CD1-CG1 3.91Å; V645-I649 HydrophobicContact CG1-CD1 4.12Å; V645-I649 WeakPolarHBondContact O-CG1 3.48Å; V645-I649 PolarHBondContact O-N 2.88Å; V646-I649 PolarHBondContact O-N 2.69Å; I649-T651 VanDerWaalsContact C-N 3.33Å; I649-T652 PolarHBondContact O-N 3.24Å; I649-T652 PolarHBondContact O-OG1 2.7Å; I649-L656 HydrophobicContact CG1-CD1 4Å; I649-L656 HydrophobicContact CG1-CD2 4.26Å; I649-L656 HydrophobicContact CG2-CD2 4.02Å; I649-L826 HydrophobicContact CG2-CD1 3.97Å
650	T	85.8	Confident	86.5	Confident	62 Å²	62	53.5 Å²	53.5	38%	0.38	27%	0.274	S	S	.	.	H	α-helix	trans	-73.5	-26.8	176.4	51.8	0	0	0	0	112.4	V646 D647 L826	V646-T650 HydrophobicContact CG1-CG2 4.23Å; V646-T650 WeakPolarHBondContact O-CB 3.46Å; V646-T650 VanDerWaalsContact O-CG2 3.32Å; V646-T650 WeakPolarHBondContact O-CG2 3.42Å; V646-T650 PolarHBondContact O-N 3.41Å; V646-T650 PolarHBondContact O-OG1 2.96Å; D647-T650 WeakPolarHBondContact CA-OG1 3.43Å; D647-T650 PolarHBondContact O-OG1 2.77Å; T650-L826 HydrophobicContact CG2-CD2 3.58Å
651	T	85.3	Confident	86.7	Confident	109 Å²	109	52.7 Å²	52.7	67%	0.669	27%	0.267	S	S	*	.	H	α-helix	trans	-71.9	-33	172.5	-59.8	0	0	0	0	112.1	D647 L648 I649 K653	D647-T651 WeakPolarHBondContact O-CB 3.44Å; D647-T651 PolarHBondContact O-N 3.39Å; D647-T651 VanDerWaalsContact O-N 3.14Å; D647-T651 PolarHBondContact O-OG1 3.1Å; L648-T651 PolarHBondContact O-N 3.16Å; I649-T651 VanDerWaalsContact C-N 3.33Å; T651-K653 PolarHBondContact O-N 3.21Å
652	T	82.5	Confident	86.7	Confident	19 Å²	19	52.6 Å²	52.6	12%	0.117	27%	0.265	C	S	.	.			trans	-71.6	113.6	172.3	54.7	0	0	0	0	110.6	Y584 N633 L648 I649 L656	Y584-T652 PolarHBondContact OH-O 3.01Å; Y584-T652 VanDerWaalsContact OH-O 3.1Å; N633-T652 VanDerWaalsContact ND2-CG2 3.25Å; N633-T652 WeakPolarHBondContact ND2-CG2 3.44Å; L648-T652 PolarHBondContact O-N 2.95Å; I649-T652 PolarHBondContact O-N 3.24Å; I649-T652 PolarHBondContact O-OG1 2.7Å; T652-L656 HydrophobicContact CG2-CD1 4.34Å
653	K	76.1	Confident	86.2	Confident	147 Å²	147	53.6 Å²	53.6	64%	0.639	27%	0.27	S	S	*	.			trans	-84.3	-43.7	-174.7	-69.9	-169.2	175.9	-174.4	0	114.1	R579 T651	R579-K653 WeakPolarHBondContact CD-O 3.35Å; R579-K653 PolarHBondContact NH1-O 3.48Å; T651-K653 PolarHBondContact O-N 3.21Å
654	D	80.7	Confident	85	Confident	122 Å²	122	53.2 Å²	53.2	65%	0.652	27%	0.27	S	S	*	.	S	Bend	trans	-114.1	-51.7	-164.6	-42.7	-45	0	0	0	111.8	R579	R579-D654 PolarHBondContact N-O 3.17Å
655	M	86.2	Confident	83.1	Confident	100 Å²	100	57.5 Å²	57.5	49%	0.493	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	129.5	-173.9	-63.5	-68.4	-85.3	0	0	111.2	I576 E578	I576-M655 HydrophobicContact CG2-CE 3.54Å; E578-M655 VanDerWaalsContact CA-SD 3.55Å; E578-M655 HydrophobicContact CB-SD 3.62Å; E578-M655 HydrophobicContact CG-SD 3.77Å
656	L	90.7	Very high	80.4	Confident	0 Å²	0	63.5 Å²	63.5	0%	0	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	107.6	-179.9	175.4	68.2	0	0	0	109.6	L577 Y584 F586 I632 I649 T652 L658	L577-L656 HydrophobicContact CB-CB 4.38Å; L577-L656 HydrophobicContact CD1-CD2 4.49Å; L577-L656 PolarHBondContact N-O 3.39Å; L577-L656 PolarHBondContact O-N 2.78Å; Y584-L656 HydrophobicContact CD1-CB 4.06Å; Y584-L656 HydrophobicContact CD1-CD2 4.21Å; Y584-L656 HydrophobicContact CD2-CD2 3.72Å; Y584-L656 HydrophobicContact CE1-CB 3.58Å; Y584-L656 HydrophobicContact CE1-CD2 4.4Å; Y584-L656 HydrophobicContact CE2-CB 4.1Å; Y584-L656 HydrophobicContact CE2-CD2 3.94Å; Y584-L656 HydrophobicContact CG-CD2 3.87Å; F586-L656 HydrophobicContact CE1-CD2 4.16Å; F586-L656 HydrophobicContact CZ-CD2 3.99Å; I632-L656 HydrophobicContact CG2-CD1 3.68Å; I649-L656 HydrophobicContact CG1-CD1 4Å; I649-L656 HydrophobicContact CG1-CD2 4.26Å; I649-L656 HydrophobicContact CG2-CD2 4.02Å; T652-L656 HydrophobicContact CG2-CD1 4.34Å; L656-L658 HydrophobicContact CD1-CD2 3.82Å; L656-L658 HydrophobicContact CD2-CD1 4.23Å; L656-L658 HydrophobicContact CD2-CD2 4.02Å; L656-L658 HydrophobicContact CD2-CG 4.15Å; L656-L658 HydrophobicContact CG-CD2 3.8Å; L656-L658 HydrophobicContact CG-CG 3.97Å
657	Q	90.5	Very high	77.6	Confident	95 Å²	95	67.5 Å²	67.5	44%	0.444	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	117.2	172.3	179.4	177.5	3.7	0	0	109.3	I575 I576 I632 N633	I575-Q657 CarbonylContact O-C 3.57Å; I575-Q657 WeakPolarHBondContact O-CA 3.32Å; I576-Q657 HydrophobicContact CG1-CB 4.31Å; I576-Q657 HydrophobicContact CG1-CG 4.15Å; I632-Q657 WeakPolarHBondContact CA-O 3.21Å; N633-Q657 PolarHBondContact N-O 3.05Å; N633-Q657 PolarHBondContact OD1-N 3.33Å; N633-Q657 PolarHBondContact OD1-O 3.35Å
658	L	91.7	Very high	74.9	Confident	0 Å²	0	73.4 Å²	73.4	0%	0	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	136.9	176.1	-59	-179.9	0	0	0	110.4	S574 I575 L577 F586 I629 I632 L656 I660	S574-L658 WeakPolarHBondContact CA-O 3.17Å; I575-L658 HydrophobicContact CD1-CB 4.46Å; I575-L658 HydrophobicContact CD1-CD1 4.45Å; I575-L658 HydrophobicContact CG1-CB 3.89Å; I575-L658 PolarHBondContact N-O 3.41Å; I575-L658 PolarHBondContact O-N 3.28Å; L577-L658 HydrophobicContact CD1-CD1 4Å; F586-L658 HydrophobicContact CE1-CD1 4.19Å; F586-L658 HydrophobicContact CZ-CD1 3.93Å; I629-L658 HydrophobicContact CD1-CD1 4.48Å; I629-L658 HydrophobicContact CG2-CD2 4.36Å; I632-L658 HydrophobicContact CB-CD2 4.49Å; I632-L658 HydrophobicContact CD1-CD2 4.24Å; I632-L658 HydrophobicContact CG1-CD2 3.79Å; I632-L658 HydrophobicContact CG2-CD2 4.42Å; L656-L658 HydrophobicContact CD1-CD2 3.82Å; L656-L658 HydrophobicContact CD2-CD1 4.23Å; L656-L658 HydrophobicContact CD2-CD2 4.02Å; L656-L658 HydrophobicContact CD2-CG 4.15Å; L656-L658 HydrophobicContact CG-CD2 3.8Å; L656-L658 HydrophobicContact CG-CG 3.97Å; L658-I660 HydrophobicContact CB-CG2 3.98Å
659	K	90.3	Very high	72.1	Confident	45 Å²	45	78.6 Å²	78.6	20%	0.196	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	123.7	164.8	-159.8	177	-159.9	166.6	0	107.5	F556 L572 R573 L630 E631	F556-K659 HydrophobicContact CE1-CD 4.24Å; F556-K659 HydrophobicContact CZ-CD 3.91Å; L572-K659 HydrophobicContact CD1-CG 4.4Å; R573-K659 WeakPolarHBondContact O-CA 3.4Å; L630-K659 HydrophobicContact CB-CB 4.49Å; L630-K659 WeakPolarHBondContact CB-O 3.32Å; L630-K659 PolarHBondContact N-O 3.23Å; E631-K659 HydrophobicContact CB-CB 3.75Å; E631-K659 HydrophobicContact CB-CD 4.03Å; E631-K659 HydrophobicContact CG-CB 4.39Å; E631-K659 HydrophobicContact CG-CD 3.84Å; E631-K659 PolarHBondContact N-O 3.5Å; E631-K659 PolarHBondContact O-N 2.95Å; E631-K659 WeakPolarHBondContact OE1-CD 3.46Å; E631-K659 IonicContact OE1-NZ 3.27Å; E631-K659 PolarHBondContact OE1-NZ 3.24Å; E631-K659 WeakPolarHBondContact OE2-CD 3.2Å; E631-K659 IonicContact OE2-NZ 2.72Å; E631-K659 PolarHBondContact OE2-NZ 3.23Å
660	I	90.3	Very high	69	Low	0 Å²	0	86.5 Å²	86.5	0%	0	44%	0.437	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	153.3	-166.9	60.1	178.4	0	0	0	111.1	L572 R573 I575 L623 D627 Y628 I629 L658	L572-I660 CarbonylContact C-O 3.49Å; L572-I660 WeakPolarHBondContact CA-O 3.28Å; R573-I660 HydrophobicContact CB-CD1 4.2Å; R573-I660 HydrophobicContact CB-CG1 3.84Å; R573-I660 PolarHBondContact N-O 3.28Å; R573-I660 PolarHBondContact O-N 2.99Å; I575-I660 HydrophobicContact CD1-CD1 4.11Å; I575-I660 HydrophobicContact CG1-CD1 4.37Å; I575-I660 HydrophobicContact CG2-CD1 4.1Å; L623-I660 HydrophobicContact CD1-CD1 3.6Å; L623-I660 HydrophobicContact CD1-CG2 4.08Å; D627-I660 HydrophobicContact CB-CB 4.42Å; Y628-I660 CarbonylContact O-C 3.58Å; Y628-I660 WeakPolarHBondContact O-CA 3.24Å; I629-I660 HydrophobicContact CG1-CG2 4.39Å; L658-I660 HydrophobicContact CB-CG2 3.98Å
661	I	87.4	Confident	66.2	Low	0 Å²	0	89.3 Å²	89.3	0%	0	46%	0.456	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	126.1	176.2	-172.9	168.9	0	0	0	111	I563 Y570 C571 L572 P605 Y628 L630 F663	I563-I661 HydrophobicContact CD1-CD1 4.4Å; I563-I661 HydrophobicContact CG2-CD1 3.62Å; Y570-I661 HydrophobicContact CD2-CD1 3.54Å; Y570-I661 HydrophobicContact CD2-CG1 4Å; Y570-I661 HydrophobicContact CE2-CD1 4.44Å; Y570-I661 HydrophobicContact CG-CD1 3.99Å; Y570-I661 HydrophobicContact CG-CG1 4.46Å; C571-I661 WeakPolarHBondContact O-CA 3.33Å; L572-I661 HydrophobicContact CD1-CB 4.38Å; P605-I661 HydrophobicContact CG-CG2 4.19Å; Y628-I661 PolarHBondContact N-O 3.32Å; Y628-I661 PolarHBondContact O-N 2.99Å; L630-I661 HydrophobicContact CD1-CB 3.8Å; L630-I661 HydrophobicContact CD1-CG2 3.72Å; L630-I661 HydrophobicContact CD2-CG2 4.1Å; L630-I661 HydrophobicContact CG-CB 4.42Å; L630-I661 HydrophobicContact CG-CG2 3.84Å; I661-F663 HydrophobicContact CD1-CE1 3.88Å; I661-F663 HydrophobicContact CD1-CZ 3.87Å; I661-F663 HydrophobicContact CG1-CE1 4.27Å; I661-F663 HydrophobicContact CG1-CZ 4.15Å; I661-F663 HydrophobicContact CG2-CE2 4.12Å; I661-F663 HydrophobicContact CG2-CZ 4.12Å
662	N	83.6	Confident	63.5	Low	30 Å²	30	95.4 Å²	95.4	16%	0.16	47%	0.466	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	145.7	168.7	-154.7	-81.9	0	0	0	110.1	Y570 C571 D627	Y570-N662 CarbonylContact C-O 3.37Å; Y570-N662 WeakPolarHBondContact CA-O 3.42Å; C571-N662 HydrophobicContact CB-CB 4.16Å; C571-N662 PolarHBondContact N-O 3.43Å; C571-N662 PolarHBondContact O-N 2.95Å; D627-N662 VanDerWaalsContact OD1-CB 3.27Å; D627-N662 WeakPolarHBondContact OD1-CB 3.42Å; D627-N662 PolarHBondContact OD1-ND2 3.46Å
663	F	75.3	Confident	60.9	Low	24 Å²	24	99.9 Å²	99.9	11%	0.105	49%	0.493	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	103	170.3	-59.7	-77.4	0	0	0	108.5	I563 Y567 L604 Y628 I661 Q665	I563-F663 HydrophobicContact CG2-CE1 4.06Å; I563-F663 HydrophobicContact CG2-CZ 4.49Å; Y567-F663 AromaticContact CD1-CD1 3.81Å; Y567-F663 HydrophobicContact CD1-CD1 3.81Å; Y567-F663 HydrophobicContact CD1-CE1 4.1Å; Y567-F663 HydrophobicContact CD2-CD1 4.29Å; Y567-F663 AromaticContact CD2-CE1 3.73Å; Y567-F663 HydrophobicContact CD2-CE1 3.73Å; Y567-F663 HydrophobicContact CD2-CZ 4.49Å; Y567-F663 HydrophobicContact CE1-CD1 4.4Å; Y567-F663 HydrophobicContact CE2-CE1 4.22Å; Y567-F663 AromaticContact CG-CD1 3.75Å; Y567-F663 HydrophobicContact CG-CD1 3.75Å; Y567-F663 AromaticContact CG-CE1 3.65Å; Y567-F663 HydrophobicContact CG-CE1 3.65Å; L604-F663 HydrophobicContact CD2-CD2 3.99Å; L604-F663 HydrophobicContact CD2-CE2 3.53Å; L604-F663 HydrophobicContact CD2-CZ 3.99Å; Y628-F663 AromaticContact CD2-CD2 3.74Å; Y628-F663 HydrophobicContact CD2-CD2 3.74Å; Y628-F663 AromaticContact CD2-CE2 3.72Å; Y628-F663 HydrophobicContact CD2-CE2 3.72Å; Y628-F663 AromaticContact CE2-CD2 3.84Å; Y628-F663 HydrophobicContact CE2-CD2 3.84Å; Y628-F663 HydrophobicContact CE2-CE2 4.09Å; Y628-F663 HydrophobicContact CG-CE2 4.28Å; I661-F663 HydrophobicContact CD1-CE1 3.88Å; I661-F663 HydrophobicContact CD1-CZ 3.87Å; I661-F663 HydrophobicContact CG1-CE1 4.27Å; I661-F663 HydrophobicContact CG1-CZ 4.15Å; I661-F663 HydrophobicContact CG2-CE2 4.12Å; I661-F663 HydrophobicContact CG2-CZ 4.12Å; F663-Q665 PolarHBondContact O-N 3.45Å
664	Q	58.7	Low	58.5	Low	120 Å²	120	100.6 Å²	100.6	56%	0.561	50%	0.503	S	S	*	.			trans	-75.8	115.4	-171.8	-73.8	-177.7	-39.2	0	0	111.1	N569	N569-Q664 HydrophobicContact CB-CB 4.47Å; N569-Q664 PolarHBondContact O-N 2.96Å
665	Q	45.9	Very low	56.1	Low	191 Å²	191	101.8 Å²	101.8	89%	0.893	51%	0.509	S	S	*	.			trans	54.1	86.7	177.9	-74	178.3	-49.9	0	0	115.5	F663	F663-Q665 PolarHBondContact O-N 3.45Å
666	L	33.5	Very low	53.2	Low	126 Å²	126	100 Å²	100	66%	0.66	52%	0.516	S	S	*	.			trans	-69.9	136.7	148.8	-74.6	167.1	0	0	0	109.4
667	P	29.1	Very low	50.3	Low	110 Å²	110	107.5 Å²	107.5	71%	0.714	56%	0.556	S	S	*	*			trans	-63.4	137.3	163.8	-18.9	32	0	0	0	110.5	I669	P667-I669 PolarHBondContact O-N 3.4Å
668	E	30.4	Very low	47.5	Very low	193 Å²	193	110.5 Å²	110.5	90%	0.902	57%	0.57	S	S	*	*			trans	-68.3	94.2	173.8	-72.9	-167	126.9	0	0	111.1	Q670	E668-Q670 PolarHBondContact O-N 2.94Å; E668-Q670 VanDerWaalsContact O-N 3.1Å
669	I	30.1	Very low	44.6	Very low	157 Å²	157	116 Å²	116	81%	0.805	60%	0.6	S	S	*	*			trans	-74.6	100.3	167.4	-58.7	179.1	0	0	0	107.7	P667	P667-I669 PolarHBondContact O-N 3.4Å
670	Q	25.3	Very low	41.7	Very low	167 Å²	167	119.6 Å²	119.6	78%	0.78	62%	0.621	S	S	*	*			trans	-52.4	130.4	174.8	-65.1	-180	1.2	0	0	110.6	E668 R672	E668-Q670 PolarHBondContact O-N 2.94Å; E668-Q670 VanDerWaalsContact O-N 3.1Å; Q670-R672 PolarHBondContact O-N 2.98Å
671	P	27.5	Very low	38.9	Very low	120 Å²	120	126.4 Å²	126.4	78%	0.779	66%	0.657	S	S	*	*			trans	-67.7	108.2	179.9	27	-33.6	0	0	0	110	V673	P671-V673 PolarHBondContact O-N 3Å
672	R	27.5	Very low	36.2	Very low	237 Å²	237	132.6 Å²	132.6	89%	0.894	69%	0.69	S	S	*	*			trans	-65.1	100.7	169.8	-81.7	-171.7	172.3	-175	-1.2	109.3	Q670 I674	Q670-R672 PolarHBondContact O-N 2.98Å; R672-I674 PolarHBondContact O-N 3.03Å; R672-I674 VanDerWaalsContact O-N 3.11Å
673	V	27.8	Very low	33.7	Very low	113 Å²	113	135.9 Å²	135.9	69%	0.685	71%	0.711	S	S	*	*			trans	-60.5	110.7	176.6	178.9	0	0	0	0	109.8	P671 N675	P671-V673 PolarHBondContact O-N 3Å; V673-N675 VanDerWaalsContact C-N 3.31Å; V673-N675 WeakPolarHBondContact CG1-OD1 3.42Å; V673-N675 PolarHBondContact O-N 3.19Å
674	I	27	Very low	31.4	Very low	162 Å²	162	142.2 Å²	142.2	83%	0.831	75%	0.747	S	S	*	*			trans	-81.3	80.5	173.2	-54.5	178.4	0	0	0	108.4	R672 G676	R672-I674 PolarHBondContact O-N 3.03Å; R672-I674 VanDerWaalsContact O-N 3.11Å; I674-G676 VanDerWaalsContact C-N 3.34Å; I674-G676 PolarHBondContact O-N 3.44Å; I674-G676 VanDerWaalsContact O-N 3.11Å
675	N	29.1	Very low	30.2	Very low	148 Å²	148	140.5 Å²	140.5	79%	0.791	75%	0.753	S	S	*	*			trans	-79.5	85.3	167.3	-91.4	7.8	0	0	0	109.7	V673	V673-N675 VanDerWaalsContact C-N 3.31Å; V673-N675 WeakPolarHBondContact CG1-OD1 3.42Å; V673-N675 PolarHBondContact O-N 3.19Å
676	G	24.9	Very low	29.4	Very low	62 Å²	62	138.4 Å²	138.4	64%	0.639	75%	0.748	S	S	*	*			trans	-77.5	120.2	164.7	0	0	0	0	0	110.5	I674	I674-G676 VanDerWaalsContact C-N 3.34Å; I674-G676 PolarHBondContact O-N 3.44Å; I674-G676 VanDerWaalsContact O-N 3.11Å
677	N	30.3	Very low	29.5	Very low	157 Å²	157	140.8 Å²	140.8	84%	0.84	76%	0.76	S	S	*	*			trans	-155.3	123.8	148.1	-119.2	-17.2	0	0	0	113.1
678	H	31.9	Very low	29.6	Very low	158 Å²	158	142.6 Å²	142.6	73%	0.731	76%	0.764	S	S	*	*			trans	-26	143.1	143	-77.5	-77.6	0	0	0	113.2
679	N	30.3	Very low	29.7	Very low	117 Å²	117	140.7 Å²	140.7	63%	0.626	75%	0.754	S	S	*	*			cis	-168	158.2	32.7	-113.6	-15.9	0	0	0	113.5
680	N	29.9	Very low	29.8	Very low	120 Å²	120	138.8 Å²	138.8	64%	0.642	76%	0.755	S	S	*	*			trans	62.2	135.4	141.6	-60.8	-10.3	0	0	0	122.8
681	N	32	Very low	30.1	Very low	142 Å²	142	135.1 Å²	135.1	76%	0.759	74%	0.741	S	S	*	*			trans	71.5	140.6	146.1	-60.5	-9.7	0	0	0	119.1
682	N	30.2	Very low	30.4	Very low	131 Å²	131	136.5 Å²	136.5	70%	0.701	74%	0.742	S	S	*	*			cis	-162.8	164.4	-25	-142.1	-13.6	0	0	0	110.2
683	T	30.5	Very low	30.6	Very low	98 Å²	98	130.7 Å²	130.7	60%	0.601	73%	0.729	S	S	*	*			trans	49.4	117.1	156.6	53.5	0	0	0	0	121.7
684	N	27.7	Very low	30.7	Very low	158 Å²	158	131 Å²	131	85%	0.845	73%	0.73	S	S	*	*			trans	66	146	134.8	-46.5	-17.1	0	0	0	118.6
685	A	33	Very low	30.8	Very low	83 Å²	83	132.4 Å²	132.4	69%	0.686	73%	0.731	S	S	*	*			cis	-157.2	159.3	21.9	0	0	0	0	0	114.7
686	N	30.3	Very low	30.7	Very low	148 Å²	148	133.9 Å²	133.9	79%	0.791	74%	0.735	S	S	*	*			trans	46.4	110.3	146.6	-58.4	-5	0	0	0	121.9
687	L	34.5	Very low	30.9	Very low	175 Å²	175	139.3 Å²	139.3	92%	0.916	75%	0.746	S	S	*	*			trans	-135.1	145.7	137.5	-99	170.3	0	0	0	109.4
688	N	32.5	Very low	30.8	Very low	148 Å²	148	139.5 Å²	139.5	79%	0.791	75%	0.747	S	S	*	*			trans	-84.2	139.7	-168.8	-55.6	-43.5	0	0	0	111.1
689	H	32.1	Very low	30.7	Very low	153 Å²	153	141.9 Å²	141.9	71%	0.708	75%	0.75	S	S	*	*			cis	92.2	85.2	38.8	-145.7	80.7	0	0	0	114.2	N691	H689-N691 PolarHBondContact CD2-ND2 3.18Å; H689-N691 PolarHBondContact NE2-ND2 2.6Å; H689-N691 VanDerWaalsContact NE2-ND2 3.17Å
690	S	31.7	Very low	30.5	Very low	117 Å²	117	143.5 Å²	143.5	82%	0.818	76%	0.764	S	S	*	*			trans	-168.6	77.5	160.9	-173.4	0	0	0	0	108.4
691	N	31.3	Very low	30.4	Very low	90 Å²	90	141.1 Å²	141.1	48%	0.481	76%	0.757	S	S	.	*				63.6	83.9	85.4	-70.9	-15.8	0	0	0	115.8	H689	H689-N691 PolarHBondContact CD2-ND2 3.18Å; H689-N691 PolarHBondContact NE2-ND2 2.6Å; H689-N691 VanDerWaalsContact NE2-ND2 3.17Å
692	N	33.4	Very low	30.2	Very low	149 Å²	149	139.5 Å²	139.5	80%	0.797	74%	0.743	S	S	*	*				-161.3	103.1	114	-88.4	-35.3	0	0	0	108.3
693	N	31.4	Very low	30.2	Very low	116 Å²	116	139.3 Å²	139.3	62%	0.62	75%	0.746	S	S	*	*				60.5	130.3	76.9	-64.7	-35.6	0	0	0	113
694	T	30	Very low	30	Very low	118 Å²	118	141.8 Å²	141.8	72%	0.724	75%	0.745	S	S	*	*			cis	-165.7	163.7	-12.7	17.5	0	0	0	0	105.1
695	K	30.5	Very low	30.3	Very low	193 Å²	193	137.4 Å²	137.4	84%	0.839	73%	0.731	S	S	*	*			cis	-159.9	157.2	27.5	-140.6	163.7	-173.8	172.5	0	110.4
696	M	26.5	Very low	30.2	Very low	178 Å²	178	140.1 Å²	140.1	88%	0.877	73%	0.733	S	S	*	*			trans	-54.6	151.5	174.9	-58.2	158.8	168.2	0	0	114.6
697	M	29.1	Very low	30.4	Very low	176 Å²	176	139.2 Å²	139.2	87%	0.867	73%	0.728	S	S	*	*				-157.4	129.4	123.5	-109.8	-178.6	-170.1	0	0	111.8
698	N	27.6	Very low	30.2	Very low	162 Å²	162	139 Å²	139	87%	0.866	72%	0.715	S	S	*	*			trans	-70	133.8	169.2	-64.5	-27.7	0	0	0	109.5
699	R	29.4	Very low	30.1	Very low	208 Å²	208	142 Å²	142	79%	0.785	72%	0.715	S	S	*	*			trans	-159.1	111.1	160.4	-117.4	162.5	-164.1	-176.1	2.2	114.5	S701	R699-S701 PolarHBondContact O-N 2.95Å
700	T	27.2	Very low	30.1	Very low	151 Å²	151	145.7 Å²	145.7	93%	0.926	72%	0.723	S	S	*	*			trans	-71.2	92.4	155.4	46.3	0	0	0	0	108.9
701	S	27	Very low	30.1	Very low	70 Å²	70	147 Å²	147	49%	0.49	72%	0.721	S	S	.	*			trans	-164	135.2	177.9	57.3	0	0	0	0	113.9	R699	R699-S701 PolarHBondContact O-N 2.95Å
702	F	27.7	Very low	29.9	Very low	108 Å²	108	148.7 Å²	148.7	47%	0.474	74%	0.735	S	S	.	*			trans	46.9	96	160	-63.5	-66.3	0	0	0	119.3	E373 R704	E373-F702 HydrophobicContact CG-CE1 4.03Å; E373-F702 HydrophobicContact CG-CZ 4.25Å; E373-F702 WeakPolarHBondContact OE1-CZ 3.21Å; F702-R704 PolarHBondContact O-N 2.86Å
703	V	30.8	Very low	29.7	Very low	127 Å²	127	148.7 Å²	148.7	77%	0.77	73%	0.73	S	S	*	*			trans	-83.6	73.6	146.6	-174.3	0	0	0	0	108.8	A705	V703-A705 HydrophobicContact CG1-CB 3.87Å; V703-A705 PolarHBondContact O-N 3.06Å
704	R	27.3	Very low	29.6	Very low	149 Å²	149	153.5 Å²	153.5	56%	0.562	74%	0.739	S	S	*	*			trans	-83.3	87.1	156.6	-88.6	-170.6	168.4	113.8	0.8	107.3	I372 E373 F702	I372-R704 PolarHBondContact O-NH2 2.81Å; E373-R704 IonicContact OE2-CZ 2.96Å; E373-R704 IonicContact OE2-NH1 2.77Å; E373-R704 PolarHBondContact OE2-NH1 3.21Å; E373-R704 IonicContact OE2-NH2 2.8Å; E373-R704 PolarHBondContact OE2-NH2 3.39Å; F702-R704 PolarHBondContact O-N 2.86Å
705	A	32.7	Very low	29.4	Very low	67 Å²	67	153.8 Å²	153.8	55%	0.554	75%	0.746	S	S	*	*			trans	-101.1	124.5	178.6	0	0	0	0	0	110.8	V703 L707	V703-A705 HydrophobicContact CG1-CB 3.87Å; V703-A705 PolarHBondContact O-N 3.06Å; A705-L707 PolarHBondContact O-N 3.16Å
706	D	31.4	Very low	29.2	Very low	139 Å²	139	151 Å²	151	74%	0.743	75%	0.746	S	S	*	*			trans	-49.3	76.5	-170.9	-71.7	-76	0	0	0	117.9	R708	D706-R708 VanDerWaalsContact C-N 3.28Å; D706-R708 PolarHBondContact O-N 3.32Å
707	L	34	Very low	29.2	Very low	129 Å²	129	148.2 Å²	148.2	68%	0.675	74%	0.743	S	S	*	*			trans	-89.7	31.8	163.5	-107.4	74.9	0	0	0	113.4	A705	A705-L707 PolarHBondContact O-N 3.16Å
708	R	30.9	Very low	29.3	Very low	171 Å²	171	146.3 Å²	146.3	65%	0.645	74%	0.741	S	S	*	*			trans	-140	51.9	175.2	-79	-167.3	167.3	146.1	1.3	114	D340 D706	D340-R708 VanDerWaalsContact CB-NH2 3.27Å; D340-R708 IonicContact OD2-CZ 3.39Å; D340-R708 VanDerWaalsContact OD2-CZ 3.3Å; D340-R708 IonicContact OD2-NH1 3.22Å; D340-R708 PolarHBondContact OD2-NH1 3.49Å; D340-R708 IonicContact OD2-NH2 2.73Å; D340-R708 PolarHBondContact OD2-NH2 2.8Å; D706-R708 VanDerWaalsContact C-N 3.28Å; D706-R708 PolarHBondContact O-N 3.32Å
709	R	30.5	Very low	29.1	Very low	210 Å²	210	143.4 Å²	143.4	79%	0.792	73%	0.726	S	S	*	*			trans	-144.2	134.4	164	-71.7	-165	179.7	-137.4	-3.1	113.1
710	R	31.3	Very low	29.1	Very low	231 Å²	231	141.3 Å²	141.3	87%	0.872	73%	0.727	S	S	*	*			trans	79	134.3	-174.4	-57.4	174.4	-69.1	179.3	-2.3	114.6
711	N	32.1	Very low	29	Very low	146 Å²	146	137.5 Å²	137.5	78%	0.781	71%	0.711	S	S	*	*			cis	-153.5	125.4	-18.4	-127.1	27.8	0	0	0	110.1
712	T	26.5	Very low	29.1	Very low	125 Å²	125	144.5 Å²	144.5	77%	0.767	73%	0.726	S	S	*	*			trans	-84.8	158.3	159.7	46.2	0	0	0	0	110
713	Q	30.4	Very low	29.1	Very low	149 Å²	149	145.4 Å²	145.4	70%	0.696	74%	0.735	S	S	*	*			trans	86	136.8	174.4	-52	-160.2	22.2	0	0	119.6
714	R	29	Very low	29	Very low	217 Å²	217	147.4 Å²	147.4	82%	0.819	74%	0.741	S	S	*	*			trans	67.8	88.5	155.9	-69.6	178.9	-177.4	-136.1	-3.8	118.7	T716	R714-T716 PolarHBondContact O-N 2.94Å
715	S	25	Very low	29.1	Very low	123 Å²	123	150.1 Å²	150.1	86%	0.86	75%	0.752	S	S	*	*			trans	-45.7	114.4	141.3	51.8	0	0	0	0	113.8
716	T	27.8	Very low	28.8	Very low	136 Å²	136	153 Å²	153	83%	0.834	76%	0.764	S	S	*	*			trans	-149.8	146.6	149.8	35.4	0	0	0	0	108.1	R714	R714-T716 PolarHBondContact O-N 2.94Å
717	S	25.9	Very low	28.8	Very low	118 Å²	118	154.2 Å²	154.2	83%	0.825	77%	0.77	S	S	*	*			trans	-76.9	151.6	177.1	50.2	0	0	0	0	112.6
718	V	30	Very low	28.7	Very low	137 Å²	137	153.5 Å²	153.5	83%	0.83	78%	0.776	S	S	*	*			trans	179.5	145.8	144.8	141.4	0	0	0	0	109.2
719	D	24.6	Very low	28.6	Very low	100 Å²	100	152.1 Å²	152.1	54%	0.535	78%	0.78	S	S	.	*			trans	-60.4	131.2	-180	-61	-104.8	0	0	0	113.8	K170	K170-D719 IonicContact NZ-OD1 2.65Å; K170-D719 PolarHBondContact NZ-OD1 3.21Å; K170-D719 IonicContact NZ-OD2 3.06Å; K170-D719 PolarHBondContact NZ-OD2 3.14Å
720	M	28.4	Very low	28.6	Very low	164 Å²	164	149.6 Å²	149.6	81%	0.808	78%	0.782	S	S	*	*			trans	-148.8	115.2	158.7	-99	-62.1	173.2	0	0	112.2
721	A	25.7	Very low	28.5	Very low	72 Å²	72	144.4 Å²	144.4	60%	0.595	77%	0.772	S	S	*	*			trans	-95.4	136.1	160.6	0	0	0	0	0	109.2
722	R	28.7	Very low	28.5	Very low	216 Å²	216	144.3 Å²	144.3	82%	0.815	77%	0.771	S	S	*	*			trans	-166.3	112.8	156.9	-110	153.6	-164.8	-151.5	3.6	115.3
723	I	28.8	Very low	28.6	Very low	127 Å²	127	144.8 Å²	144.8	65%	0.651	77%	0.767	S	S	*	*			trans	51.1	97.5	131.1	-51.3	175.6	0	0	0	116.9	R725	I723-R725 HydrophobicContact CG2-CB 3.73Å; I723-R725 HydrophobicContact CG2-CG 3.87Å
724	N	27.6	Very low	28.5	Very low	169 Å²	169	146 Å²	146	90%	0.904	78%	0.776	S	S	*	*			trans	-80.7	110	138.1	-83.9	-17.8	0	0	0	108.3
725	R	29.2	Very low	28.5	Very low	207 Å²	207	140.1 Å²	140.1	78%	0.781	77%	0.773	S	S	*	*			trans	-121.8	134	160.6	-102	-169.8	178.3	-162.9	1	107.6	I723	I723-R725 HydrophobicContact CG2-CB 3.73Å; I723-R725 HydrophobicContact CG2-CG 3.87Å
726	P	28.1	Very low	28.8	Very low	127 Å²	127	142.3 Å²	142.3	83%	0.825	78%	0.775	S	S	*	*			trans	-67.6	135.3	167.3	30.4	-32.8	0	0	0	108.7
727	L	30.9	Very low	28.9	Very low	164 Å²	164	143.3 Å²	143.3	86%	0.859	78%	0.775	S	S	*	*			trans	-123.1	124.8	167.7	-83.6	171	0	0	0	109
728	S	32.2	Very low	29.2	Very low	114 Å²	114	145.2 Å²	145.2	80%	0.797	77%	0.771	S	S	*	*			trans	-68	155.6	169.6	47.1	0	0	0	0	110.9
729	I	28.1	Very low	29.2	Very low	143 Å²	143	145.6 Å²	145.6	73%	0.733	76%	0.762	S	S	*	*			trans	-59.8	134.4	170.1	-64.4	156.2	0	0	0	109.4
730	D	31.2	Very low	29.5	Very low	157 Å²	157	146.8 Å²	146.8	84%	0.84	77%	0.766	S	S	*	*				-157.2	157.3	128.9	-111.4	-34.7	0	0	0	112.3
731	N	29.1	Very low	29.5	Very low	121 Å²	121	145.2 Å²	145.2	65%	0.647	77%	0.766	S	S	*	*			trans	-102.8	145.2	-166	-63.9	-85.1	0	0	0	113.1
732	N	31.4	Very low	29.7	Very low	145 Å²	145	147.6 Å²	147.6	78%	0.775	77%	0.768	S	S	*	*			trans	165.3	113.5	138.3	-82.5	-34	0	0	0	107.9
733	I	28.1	Very low	29.7	Very low	134 Å²	134	144.1 Å²	144.1	69%	0.687	77%	0.765	S	S	*	*				79.9	130.7	64.7	-68.3	174.2	0	0	0	112.7
734	M	29.8	Very low	29.8	Very low	176 Å²	176	143.8 Å²	143.8	87%	0.867	77%	0.77	S	S	*	*			trans	65.4	103.6	-179.1	-66.9	164.5	-173.5	0	0	114.4
735	A	28.8	Very low	29.9	Very low	93 Å²	93	141 Å²	141	77%	0.769	76%	0.759	S	S	*	*			cis	77.4	118.1	44.9	0	0	0	0	0	114.9
736	N	31.5	Very low	30	Very low	168 Å²	168	137.5 Å²	137.5	90%	0.898	76%	0.756	S	S	*	*			trans	-157.7	121.6	156.4	-107.8	-35.6	0	0	0	110.3
737	N	28.5	Very low	30.1	Very low	157 Å²	157	136.8 Å²	136.8	84%	0.84	75%	0.749	S	S	*	*			trans	-106.6	131.8	176.8	-76.8	-30	0	0	0	110.1
738	H	32.7	Very low	30.1	Very low	159 Å²	159	134.7 Å²	134.7	74%	0.736	74%	0.743	S	S	*	*			trans	-158.9	149.4	162.8	-101.5	47.5	0	0	0	108.4
739	K	30.8	Very low	30	Very low	145 Å²	145	134.8 Å²	134.8	63%	0.63	74%	0.739	S	S	*	*			cis	-159.5	131.9	-19.1	-117.6	-170.9	-175.6	150.7	0	107.7
740	I	29.5	Very low	30.1	Very low	124 Å²	124	134.1 Å²	134.1	64%	0.636	74%	0.737	S	S	*	*				63.7	126.1	106.5	-66.3	-178.1	0	0	0	117.1	I742	I740-I742 HydrophobicContact CG2-CD1 4.17Å; I740-I742 HydrophobicContact CG2-CG1 3.74Å
741	T	30.1	Very low	30.2	Very low	132 Å²	132	132.7 Å²	132.7	81%	0.81	73%	0.729	S	S	*	*			trans	-160.5	89.8	137.6	-72.6	0	0	0	0	106.1
742	I	28.6	Very low	30.3	Very low	122 Å²	122	132 Å²	132	63%	0.626	73%	0.725	S	S	*	*				92	118.4	83.6	-75.8	159.4	0	0	0	113	I740	I740-I742 HydrophobicContact CG2-CD1 4.17Å; I740-I742 HydrophobicContact CG2-CG1 3.74Å
743	N	29.7	Very low	30.2	Very low	142 Å²	142	134.3 Å²	134.3	76%	0.759	73%	0.725	S	S	*	*			trans	-167.3	114.7	130.3	-98.3	-21.8	0	0	0	111.5
744	T	29.4	Very low	30.3	Very low	121 Å²	121	134.5 Å²	134.5	74%	0.742	73%	0.727	S	S	*	*			trans	36.8	133.2	133.7	47	0	0	0	0	121
745	T	30.8	Very low	30.1	Very low	111 Å²	111	131.3 Å²	131.3	68%	0.681	72%	0.722	S	S	*	*			cis	-144.2	170.5	-2.2	59.1	0	0	0	0	108.9
746	N	30.6	Very low	30.3	Very low	133 Å²	133	129.9 Å²	129.9	71%	0.711	72%	0.717	S	S	*	*				-165.7	144.5	58.6	-102.9	-21	0	0	0	113.5
747	T	30	Very low	30	Very low	111 Å²	111	127.3 Å²	127.3	68%	0.681	71%	0.712	S	S	*	*			trans	51.3	119.9	146.6	59.3	0	0	0	0	122.4
748	T	30.6	Very low	30.1	Very low	121 Å²	121	125.1 Å²	125.1	74%	0.742	71%	0.709	S	S	*	*			trans	61.7	141.8	136.9	58.7	0	0	0	0	119.4
749	T	31	Very low	29.9	Very low	115 Å²	115	122.9 Å²	122.9	71%	0.706	71%	0.707	S	S	*	*			cis	-177.4	152.7	2.2	24.3	0	0	0	0	106.4
750	N	29.5	Very low	29.8	Very low	130 Å²	130	122.5 Å²	122.5	70%	0.695	71%	0.711	S	S	*	*			cis	-167.3	172	-13.9	-129.2	67.9	0	0	0	108.7
751	N	33.1	Very low	29.9	Very low	127 Å²	127	122.7 Å²	122.7	68%	0.679	71%	0.714	S	S	*	*			trans	66.7	150.8	161.5	-66.1	30.1	0	0	0	118.7
752	D	31	Very low	30	Very low	105 Å²	105	121.5 Å²	121.5	56%	0.561	70%	0.702	S	S	*	*			cis	-174.8	157.4	-31.7	-113.8	-24.2	0	0	0	110.4
753	Y	30.4	Very low	30.1	Very low	195 Å²	195	123.4 Å²	123.4	77%	0.765	71%	0.709	S	S	*	*			trans	59.3	155.2	152.9	-66.9	-44.9	0	0	0	120.8
754	N	29	Very low	30.2	Very low	138 Å²	138	122.1 Å²	122.1	74%	0.738	71%	0.705	S	S	*	*			cis	-155.7	-170.6	-28.3	-151.1	-8.4	0	0	0	110.4
755	S	27.4	Very low	30.3	Very low	108 Å²	108	121.8 Å²	121.8	76%	0.755	70%	0.704	S	S	*	*			trans	-74.2	165.7	-178.1	54.2	0	0	0	0	117.3
756	G	31.3	Very low	30.2	Very low	64 Å²	64	122.9 Å²	122.9	66%	0.66	71%	0.705	S	S	*	*			trans	151.8	110.3	169.4	0	0	0	0	0	110.2
757	S	27.1	Very low	30.2	Very low	114 Å²	114	121.4 Å²	121.4	80%	0.797	70%	0.701	S	S	*	*			cis	86	149.5	38.4	90.2	0	0	0	0	114.4
758	S	30.5	Very low	30.1	Very low	110 Å²	110	122.3 Å²	122.3	77%	0.769	70%	0.702	S	S	*	*			trans	69.9	156.4	-177.4	83.5	0	0	0	0	116.5
759	T	28.3	Very low	30	Very low	113 Å²	113	125.5 Å²	125.5	69%	0.693	70%	0.702	S	S	*	*				-174.2	159.2	-60.6	26.3	0	0	0	0	109.6
760	N	29	Very low	30	Very low	137 Å²	137	128.9 Å²	128.9	73%	0.733	71%	0.706	S	S	*	*			trans	78.6	141.7	148.7	-68.5	-2.4	0	0	0	121.1
761	N	30.3	Very low	29.8	Very low	128 Å²	128	126.7 Å²	126.7	68%	0.684	70%	0.701	S	S	*	*			trans	72	137.7	154.6	-68.5	30.3	0	0	0	118.4
762	D	32.5	Very low	29.6	Very low	107 Å²	107	126 Å²	126	57%	0.572	70%	0.697	S	S	*	*			cis	-152.2	145.3	4.8	-117.1	-46.2	0	0	0	111.8
763	Q	31.3	Very low	29.4	Very low	162 Å²	162	126.7 Å²	126.7	76%	0.757	70%	0.7	S	S	*	*			trans	59.8	146.5	143.3	-75.8	169	63.6	0	0	121.1
764	V	31.4	Very low	29.6	Very low	114 Å²	114	120 Å²	120	69%	0.691	68%	0.68	S	S	*	*			cis	-161.1	149.8	-11.1	94.2	0	0	0	0	110.6
765	T	31.2	Very low	29.4	Very low	115 Å²	115	119.4 Å²	119.4	71%	0.706	68%	0.677	S	S	*	*			trans	59.6	144.6	165.8	54.9	0	0	0	0	120.1
766	N	28.3	Very low	29.5	Very low	133 Å²	133	122.3 Å²	122.3	71%	0.711	68%	0.678	S	S	*	*			cis	-160.2	157.8	-20.7	-131	-4.6	0	0	0	111
767	T	31.5	Very low	29.2	Very low	103 Å²	103	127.6 Å²	127.6	63%	0.632	68%	0.683	S	S	*	*			trans	44.9	112.1	151.2	55	0	0	0	0	118.8
768	N	27.9	Very low	29.3	Very low	130 Å²	130	131.7 Å²	131.7	70%	0.695	69%	0.687	S	S	*	*				47.8	143.5	52.5	-57.7	-29.8	0	0	0	113.1
769	Y	28.7	Very low	29	Very low	188 Å²	188	130.9 Å²	130.9	74%	0.737	68%	0.681	S	S	*	*			cis	-133.4	165.9	22.9	-79.6	-97.1	0	0	0	109.7
770	K	29.8	Very low	29	Very low	185 Å²	185	130 Å²	130	80%	0.804	68%	0.68	S	S	*	*				52.3	142.4	60.8	-89.9	-174.4	179.3	-173.7	0	112.2
771	S	26.3	Very low	28.8	Very low	84 Å²	84	131 Å²	131	59%	0.587	68%	0.68	S	S	*	*			cis	-179.1	170.8	-11.4	39.8	0	0	0	0	109.6
772	I	28.7	Very low	28.9	Very low	114 Å²	114	131.7 Å²	131.7	59%	0.585	68%	0.679	S	S	*	*			trans	75.6	134.7	157.9	-74.5	151.5	0	0	0	115.8
773	L	27.4	Very low	28.8	Very low	119 Å²	119	133.5 Å²	133.5	62%	0.623	68%	0.684	S	S	*	*			cis	93.2	152.9	44.6	-111.1	177.8	0	0	0	112	L1132 I1133	L773-L1132 CarbonylContact O-C 3.53Å; L773-L1132 VanDerWaalsContact O-C 3.28Å; L773-I1133 VanDerWaalsContact C-N 3.25Å; L773-I1133 CarbonylContact C-O 3.28Å; L773-I1133 VanDerWaalsContact C-O 3.27Å; L773-I1133 PolarHBondContact O-N 2.81Å
774	P	33	Very low	28.8	Very low	55 Å²	55	133 Å²	133	36%	0.357	68%	0.679	S	S	.	*			cis	-116.3	161.2	-47.3	36.2	-34.5	0	0	0	119.1	L1132 I1133	P774-L1132 WeakPolarHBondContact O-CD2 3.39Å; P774-I1133 CarbonylContact C-O 3.28Å; P774-I1133 WeakPolarHBondContact CA-O 3.44Å; P774-I1133 CarbonylContact O-C 3.57Å; P774-I1133 VanDerWaalsContact O-C 3.28Å; P774-I1133 PolarHBondContact O-N 2.72Å
775	D	25.8	Very low	28.8	Very low	125 Å²	125	136.4 Å²	136.4	67%	0.668	68%	0.68	S	S	*	*			trans	53.4	108.6	148.6	-96	-13.5	0	0	0	120	I1133	D775-I1133 PolarHBondContact N-O 3.5Å
776	Q	29.4	Very low	28.7	Very low	168 Å²	168	140.1 Å²	140.1	79%	0.785	68%	0.681	S	S	*	*			trans	-158.6	-179.9	138.6	-117.5	145.2	118.6	0	0	118.3
777	K	26	Very low	28.8	Very low	176 Å²	176	140.6 Å²	140.6	77%	0.765	68%	0.683	S	S	*	*			trans	-116.7	170.4	-163.4	-63.5	168.2	-177.8	156.2	0	112.7
778	F	27.4	Very low	28.8	Very low	200 Å²	200	141.1 Å²	141.1	88%	0.877	69%	0.686	S	S	*	*			trans	68.4	159.4	174.3	-60.9	-84.6	0	0	0	112.3
779	S	24.9	Very low	29.1	Very low	92 Å²	92	139.5 Å²	139.5	64%	0.643	68%	0.684	S	S	*	*			cis	-177.7	161.3	-20.8	169.8	0	0	0	0	105.3
780	S	27.5	Very low	29.3	Very low	95 Å²	95	136.8 Å²	136.8	66%	0.664	68%	0.683	S	S	*	*			trans	52.7	101	159.9	39.1	0	0	0	0	116.5
781	E	26.8	Very low	29.4	Very low	158 Å²	158	134.3 Å²	134.3	74%	0.738	68%	0.683	S	S	*	*				85.6	131.5	87.6	-92	-160.8	92.6	0	0	115
782	Q	30.6	Very low	29.8	Very low	143 Å²	143	134 Å²	134	67%	0.668	69%	0.693	S	S	*	*			trans	66.9	149.2	157.5	-59.9	177	40.5	0	0	116.4
783	H	31.8	Very low	29.9	Very low	145 Å²	145	135.3 Å²	135.3	67%	0.671	70%	0.701	S	S	*	*			cis	-161.9	160	-11.3	-119.5	-9	0	0	0	111.7
784	F	30.1	Very low	30.1	Very low	150 Å²	150	135.8 Å²	135.8	66%	0.658	71%	0.705	S	S	*	*			trans	68	122.4	157.1	-83.5	-124.6	0	0	0	118.1
785	R	31.4	Very low	29.9	Very low	187 Å²	187	138.4 Å²	138.4	71%	0.706	72%	0.719	S	S	*	*				78.5	143.4	74.6	-78.8	-161.4	-169.8	-168.1	2.5	113.9
786	R	29.6	Very low	30.2	Very low	192 Å²	192	139.6 Å²	139.6	73%	0.725	73%	0.726	S	S	*	*			cis	-177.4	171.8	-12.3	-165.4	-174.9	-153.6	-171.3	6	107.7
787	L	30.1	Very low	30.1	Very low	144 Å²	144	135.8 Å²	135.8	75%	0.754	72%	0.718	S	S	*	*			trans	83.3	151.6	160.4	-55.7	173.6	0	0	0	118.2
788	V	32.8	Very low	30.4	Very low	114 Å²	114	134.4 Å²	134.4	69%	0.691	72%	0.719	S	S	*	*			cis	-168.4	154.1	-31.4	77	0	0	0	0	111.7
789	S	32.7	Very low	30.4	Very low	95 Å²	95	130 Å²	130	66%	0.664	71%	0.708	S	S	*	*			trans	62.9	169.4	150.7	85.6	0	0	0	0	120.6
790	D	32.6	Very low	30.8	Very low	132 Å²	132	132 Å²	132	71%	0.706	71%	0.712	S	S	*	*			cis	-158.7	170.6	-6.2	-138	-31.3	0	0	0	115
791	T	33.5	Very low	30.8	Very low	133 Å²	133	133.6 Å²	133.6	82%	0.816	71%	0.713	S	S	*	*			trans	62.8	155.1	160.5	58.4	0	0	0	0	119.1
792	G	33.5	Very low	31	Very low	76 Å²	76	132.8 Å²	132.8	78%	0.784	71%	0.714	S	S	*	*			cis	162.8	171.1	-1.3	0	0	0	0	0	109.6
793	N	30.6	Very low	31	Very low	142 Å²	142	131.2 Å²	131.2	76%	0.759	71%	0.714	S	S	*	*			cis	-165.6	-177.9	-13.6	-166.3	16.5	0	0	0	109.8
794	N	31.9	Very low	30.8	Very low	130 Å²	130	129.1 Å²	129.1	70%	0.695	71%	0.712	S	S	*	*			trans	78.8	134.3	169.4	-52.9	-8.2	0	0	0	117
795	T	29	Very low	30.9	Very low	109 Å²	109	129.1 Å²	129.1	67%	0.669	72%	0.718	S	S	*	*			cis	103.1	115.4	10.9	70.4	0	0	0	0	117.4
796	N	31.4	Very low	30.8	Very low	150 Å²	150	125.5 Å²	125.5	80%	0.802	71%	0.713	S	S	*	*			trans	158	132.1	140.5	-79.4	-4.8	0	0	0	108.6
797	S	28	Very low	30.8	Very low	88 Å²	88	123 Å²	123	62%	0.615	71%	0.714	S	S	*	*			cis	105.1	102.8	19	75	0	0	0	0	114.3
798	N	31.4	Very low	30.9	Very low	148 Å²	148	121.1 Å²	121.1	79%	0.791	71%	0.713	S	S	*	*			trans	164.6	122.2	147.7	-82.6	-16.1	0	0	0	107.2
799	T	28.9	Very low	30.6	Very low	107 Å²	107	126.7 Å²	126.7	66%	0.656	72%	0.723	S	S	*	*			cis	86.6	137.8	39.1	67.9	0	0	0	0	115.3
800	N	31.9	Very low	30.4	Very low	134 Å²	134	133 Å²	133	72%	0.717	73%	0.733	S	S	*	*			trans	75	147.7	166.6	-54.3	-23.7	0	0	0	117
801	N	29.2	Very low	30.2	Very low	128 Å²	128	138.2 Å²	138.2	68%	0.684	74%	0.742	S	S	*	*			cis	-169.8	-177.4	-24.5	-104.9	-16.7	0	0	0	108.7
802	N	31.1	Very low	29.9	Very low	142 Å²	142	136.7 Å²	136.7	76%	0.759	74%	0.737	S	S	*	*			trans	76.6	148.9	157.8	-63	-11.5	0	0	0	118.6
803	T	28.8	Very low	29.6	Very low	109 Å²	109	140.4 Å²	140.4	67%	0.669	74%	0.737	S	S	*	*			cis	-172	162.7	-46	21.4	0	0	0	0	110
804	T	28.6	Very low	29.3	Very low	102 Å²	102	142 Å²	142	63%	0.626	74%	0.74	S	S	*	*			trans	51.8	111.6	151.1	51.9	0	0	0	0	120.2
805	N	31	Very low	29	Very low	149 Å²	149	140.4 Å²	140.4	80%	0.797	74%	0.739	S	S	*	*				178.6	158.1	108.5	-89.4	-32.9	0	0	0	110.3
806	N	30.1	Very low	28.9	Very low	112 Å²	112	143.7 Å²	143.7	60%	0.599	75%	0.752	S	S	*	*			cis	167.1	130.1	-37.5	-108.9	-33.7	0	0	0	107
807	N	29.8	Very low	28.6	Very low	140 Å²	140	143.4 Å²	143.4	75%	0.749	75%	0.75	S	S	*	*			trans	75.1	147.1	151.7	-61.2	-34.9	0	0	0	123.1
808	S	31.6	Very low	28.5	Very low	103 Å²	103	144.8 Å²	144.8	72%	0.72	76%	0.757	S	S	*	*			trans	79.5	132.9	169.7	-39.1	0	0	0	0	115.1
809	Y	27.3	Very low	28.2	Very low	232 Å²	232	139.3 Å²	139.3	91%	0.91	74%	0.736	S	S	*	*			cis	-123.1	168.5	20.3	-97.9	-100.2	0	0	0	115.6
810	R	28.3	Very low	28.1	Very low	228 Å²	228	142.7 Å²	142.7	86%	0.86	74%	0.741	S	S	*	*			trans	-139.6	156	179.8	-174.6	-179.5	-177	-172.4	3.1	108.5
811	R	28.4	Very low	27.9	Very low	241 Å²	241	139.8 Å²	139.8	91%	0.909	73%	0.731	S	S	*	*			trans	78.9	149.3	-169.2	-47.8	170.3	-166.8	-166.9	4.1	111.9
812	S	28	Very low	28	Very low	101 Å²	101	138.9 Å²	138.9	71%	0.706	72%	0.723	S	S	*	*			cis	-151.2	135.9	-2.6	27.7	0	0	0	0	108.4
813	I	25.5	Very low	27.9	Very low	154 Å²	154	135.9 Å²	135.9	79%	0.79	71%	0.713	S	S	*	*				40.3	92.9	93.1	-56.2	178.5	0	0	0	112.7
814	Q	25.8	Very low	28	Very low	176 Å²	176	131.9 Å²	131.9	82%	0.822	69%	0.691	S	S	*	*				-173.5	138.2	108.5	-118.5	153.8	-2.2	0	0	113.9
815	S	24.5	Very low	28	Very low	96 Å²	96	131.4 Å²	131.4	67%	0.671	69%	0.688	S	S	*	*			trans	25.6	105.5	154	58.7	0	0	0	0	120.9
816	L	27.4	Very low	28	Very low	178 Å²	178	126 Å²	126	93%	0.932	66%	0.659	S	S	*	*				-132.8	135	122.5	-97.8	163.5	0	0	0	106.7
817	N	24.7	Very low	27.9	Very low	144 Å²	144	125 Å²	125	77%	0.77	65%	0.652	S	S	*	*	P	Polyproline II helix	trans	-72.9	145.2	-156.9	-68.6	-39.6	0	0	0	113.8	G819	N817-G819 PolarHBondContact O-N 2.73Å
818	P	25.7	Very low	27.8	Very low	116 Å²	116	120.3 Å²	120.3	75%	0.753	63%	0.627	S	S	*	*	P	Polyproline II helix	trans	-64.4	121.3	158.5	29.1	-31.9	0	0	0	108.9	K820	P818-K820 PolarHBondContact O-N 3.22Å
819	G	26.7	Very low	27.5	Very low	34 Å²	34	122.7 Å²	122.7	35%	0.351	63%	0.627	S	S	.	*	P	Polyproline II helix	trans	-56.5	131.6	160.4	0	0	0	0	0	108.1	N817 S821	N817-G819 PolarHBondContact O-N 2.73Å; G819-S821 VanDerWaalsContact C-N 3.34Å; G819-S821 PolarHBondContact O-N 2.98Å
820	K	24.9	Very low	27.3	Very low	178 Å²	178	117.6 Å²	117.6	77%	0.774	62%	0.615	S	S	*	*			trans	-66.9	87	-170.4	-69.4	-178.6	177.2	-178.7	0	111.6	P818 Q822	P818-K820 PolarHBondContact O-N 3.22Å; K820-Q822 VanDerWaalsContact C-N 3.27Å; K820-Q822 HydrophobicContact CB-CG 4.28Å; K820-Q822 PolarHBondContact O-N 2.96Å
821	S	29.4	Very low	27.2	Very low	72 Å²	72	116 Å²	116	50%	0.503	62%	0.617	S	S	.	*			trans	-69	88.1	161.4	-57.6	0	0	0	0	108.5	G819 S823	G819-S821 VanDerWaalsContact C-N 3.34Å; G819-S821 PolarHBondContact O-N 2.98Å; S821-S823 PolarHBondContact O-N 3.5Å
822	Q	30.8	Very low	27.1	Very low	109 Å²	109	109.5 Å²	109.5	51%	0.509	61%	0.605	S	S	.	*			trans	-70	113.7	178.9	-63	-174.8	87.7	0	0	109.2	D592 H642 K820 A824	D592-Q822 PolarHBondContact OD2-NE2 2.88Å; H642-Q822 PolarHBondContact CD2-O 3.48Å; H642-Q822 PolarHBondContact NE2-O 3.44Å; H642-Q822 VanDerWaalsContact NE2-O 3.15Å; K820-Q822 VanDerWaalsContact C-N 3.27Å; K820-Q822 HydrophobicContact CB-CG 4.28Å; K820-Q822 PolarHBondContact O-N 2.96Å; Q822-A824 PolarHBondContact O-N 3.41Å
823	S	29.4	Very low	27.1	Very low	80 Å²	80	111.8 Å²	111.8	56%	0.559	61%	0.609	S	S	*	*			trans	-78.8	91	166.9	55	0	0	0	0	108.7	S821 V825	S821-S823 PolarHBondContact O-N 3.5Å; S823-V825 PolarHBondContact O-N 2.95Å
824	A	30.9	Very low	27.1	Very low	25 Å²	25	113.4 Å²	113.4	21%	0.207	61%	0.614	C	S	.	*			trans	-67	100.2	176.3	0	0	0	0	0	110.8	H642 V646 Q822 L826	H642-A824 VanDerWaalsContact NE2-CB 3.32Å; H642-A824 WeakPolarHBondContact NE2-CB 3.42Å; V646-A824 HydrophobicContact CG2-CB 3.74Å; Q822-A824 PolarHBondContact O-N 3.41Å; A824-L826 PolarHBondContact O-N 3.42Å
825	V	28.4	Very low	27.3	Very low	91 Å²	91	111.8 Å²	111.8	55%	0.552	61%	0.61	S	S	*	*			trans	-75.3	91.2	171.3	177.9	0	0	0	0	108.2	S823 I827	S823-V825 PolarHBondContact O-N 2.95Å; V825-I827 HydrophobicContact CG1-CB 4.34Å; V825-I827 HydrophobicContact CG1-CD1 3.6Å; V825-I827 HydrophobicContact CG1-CG1 3.71Å; V825-I827 PolarHBondContact O-N 3.09Å
826	L	31.1	Very low	27.6	Very low	37 Å²	37	115.9 Å²	115.9	19%	0.194	62%	0.615	C	S	.	*			trans	-77.3	56.4	177.3	-78.7	171.3	0	0	0	112.5	M588 V646 I649 T650 A824 I828	M588-L826 HydrophobicContact CE-CD1 4.39Å; V646-L826 HydrophobicContact CG1-CD2 4.35Å; I649-L826 HydrophobicContact CG2-CD1 3.97Å; T650-L826 HydrophobicContact CG2-CD2 3.58Å; A824-L826 PolarHBondContact O-N 3.42Å; L826-I828 PolarHBondContact O-N 3.23Å
827	I	26.8	Very low	27.6	Very low	89 Å²	89	115.5 Å²	115.5	46%	0.456	61%	0.614	S	S	.	*			trans	-80.7	104.1	158.8	-65.8	169.5	0	0	0	106.1	V825 E829	V825-I827 HydrophobicContact CG1-CB 4.34Å; V825-I827 HydrophobicContact CG1-CD1 3.6Å; V825-I827 HydrophobicContact CG1-CG1 3.71Å; V825-I827 PolarHBondContact O-N 3.09Å; I827-E829 HydrophobicContact CG2-CG 3.85Å; I827-E829 PolarHBondContact O-N 2.96Å
828	I	28	Very low	27.9	Very low	43 Å²	43	113.2 Å²	113.2	22%	0.221	61%	0.61	C	S	.	*			trans	-97.1	79.3	174.3	-42.7	175.4	0	0	0	108.7	L826	L826-I828 PolarHBondContact O-N 3.23Å
829	E	24.6	Very low	28.2	Very low	152 Å²	152	116.3 Å²	116.3	71%	0.71	62%	0.619	S	S	*	*			trans	-64.8	136.7	167.3	-82.9	169.3	-167	0	0	110.2	I827 E831	I827-E829 HydrophobicContact CG2-CG 3.85Å; I827-E829 PolarHBondContact O-N 2.96Å; E829-E831 PolarHBondContact O-N 2.73Å
830	N	25	Very low	28.4	Very low	126 Å²	126	117.8 Å²	117.8	67%	0.674	63%	0.634	S	S	*	*			trans	-83.3	98.9	175.6	-73.7	-17.9	0	0	0	109.3	T832	N830-T832 PolarHBondContact O-N 3.13Å
831	E	25.3	Very low	28.7	Very low	193 Å²	193	115.6 Å²	115.6	90%	0.902	64%	0.636	S	S	*	*			trans	-72.5	69.6	166.9	-74.3	-157.5	123.9	0	0	111.7	E829	E829-E831 PolarHBondContact O-N 2.73Å
832	T	26.5	Very low	28.6	Very low	105 Å²	105	117.5 Å²	117.5	64%	0.644	65%	0.645	S	S	*	*			trans	-138.4	82.4	166.2	55.4	0	0	0	0	109.8	N830	N830-T832 PolarHBondContact O-N 3.13Å
833	D	28.1	Very low	28.5	Very low	149 Å²	149	119.4 Å²	119.4	80%	0.797	66%	0.657	S	S	*	*				172.1	103.1	114.1	-84.8	-10.8	0	0	0	112.8	L835	D833-L835 VanDerWaalsContact C-N 3.32Å; D833-L835 PolarHBondContact O-N 3.4Å
834	Q	25.7	Very low	28.4	Very low	189 Å²	189	120.7 Å²	120.7	88%	0.883	66%	0.662	S	S	*	*			trans	-80.4	69.9	170.2	-67.4	-172.1	14.2	0	0	112
835	L	30.1	Very low	28.4	Very low	142 Å²	142	125.1 Å²	125.1	74%	0.743	69%	0.686	S	S	*	*			trans	-125.8	77.4	172.5	-78.7	-179	0	0	0	115	D833	D833-L835 VanDerWaalsContact C-N 3.32Å; D833-L835 PolarHBondContact O-N 3.4Å
836	K	31	Very low	28.3	Very low	181 Å²	181	130 Å²	130	79%	0.787	70%	0.703	S	S	*	*			trans	52.6	110.9	130.8	-63.7	175.6	-179.2	174.8	0	118.8	S838	K836-S838 PolarHBondContact O-N 3.35Å
837	N	26.9	Very low	28.5	Very low	171 Å²	171	133.3 Å²	133.3	91%	0.914	73%	0.727	S	S	*	*			trans	-53.7	124.4	148.5	-72.6	-36.7	0	0	0	111.8
838	S	31.7	Very low	28.7	Very low	96 Å²	96	137.4 Å²	137.4	67%	0.671	75%	0.749	S	S	*	*			trans	-175.7	132.9	134.7	58.3	0	0	0	0	111.6	K836	K836-S838 PolarHBondContact O-N 3.35Å
839	L	31.6	Very low	28.9	Very low	180 Å²	180	140.3 Å²	140.3	94%	0.942	77%	0.772	S	S	*	*			trans	43.4	118.2	145.2	-56.7	163.2	0	0	0	118.1
840	G	31.3	Very low	29.1	Very low	65 Å²	65	138 Å²	138	67%	0.67	77%	0.773	S	S	*	*			cis	150.1	175.4	3.7	0	0	0	0	0	111.3
841	T	30.3	Very low	29.7	Very low	132 Å²	132	136.8 Å²	136.8	81%	0.81	77%	0.772	S	S	*	*			trans	63.7	105.4	163.3	22.1	0	0	0	0	120.2
842	T	26.8	Very low	29.9	Very low	113 Å²	113	132.7 Å²	132.7	69%	0.693	77%	0.765	S	S	*	*				72	138.7	129	47.2	0	0	0	0	123.8
843	I	29.5	Very low	30.3	Very low	148 Å²	148	133.1 Å²	133.1	76%	0.759	77%	0.768	S	S	*	*			trans	73.4	130.7	142.7	-70.9	164.6	0	0	0	116.8
844	T	26.7	Very low	30.5	Very low	108 Å²	108	131 Å²	131	66%	0.663	77%	0.765	S	S	*	*			cis	-163	-177.1	-13.7	33.4	0	0	0	0	109.6
845	T	31	Very low	31	Very low	118 Å²	118	126.8 Å²	126.8	72%	0.724	76%	0.756	S	S	*	*			trans	69	91.8	145.2	39.3	0	0	0	0	120.9
846	Q	26.5	Very low	31.2	Very low	192 Å²	192	125.2 Å²	125.2	90%	0.897	76%	0.757	S	S	*	*				61.5	159	117.2	-79.5	-158.2	-13.1	0	0	123.6
847	P	35.4	Very low	31.4	Very low	108 Å²	108	122.1 Å²	122.1	70%	0.701	76%	0.758	S	S	*	*			trans	-116.5	160.3	-164.8	42.3	-31.1	0	0	0	116
848	L	29.8	Very low	31.9	Very low	175 Å²	175	118.7 Å²	118.7	92%	0.916	75%	0.745	S	S	*	*			trans	-170.7	159.5	162.5	-88.2	132	0	0	0	106.3
849	S	32.2	Very low	32.1	Very low	103 Å²	103	121.9 Å²	121.9	72%	0.72	75%	0.749	S	S	*	*			cis	-162	168.7	-9.4	51	0	0	0	0	110.5
850	S	29.6	Very low	32.2	Very low	103 Å²	103	119.6 Å²	119.6	72%	0.72	74%	0.736	S	S	*	*			trans	-83.3	-162.7	168.3	58	0	0	0	0	111
851	P	38	Very low	32.2	Very low	102 Å²	102	123.1 Å²	123.1	66%	0.662	74%	0.738	S	S	*	*			cis	-146.5	-169.8	1.5	43	-22.3	0	0	0	117.9
852	S	29.9	Very low	32.3	Very low	106 Å²	106	123.3 Å²	123.3	74%	0.741	73%	0.734	S	S	*	*			trans	76.6	163.3	143.5	78.2	0	0	0	0	119.9
853	T	33.3	Very low	32.5	Very low	115 Å²	115	122.3 Å²	122.3	71%	0.706	73%	0.728	S	S	*	*			cis	-143.1	170.9	6.6	49.4	0	0	0	0	113.4
854	S	33.8	Very low	32.6	Very low	105 Å²	105	124.7 Å²	124.7	73%	0.734	73%	0.729	S	S	*	*			trans	67.1	145.4	144.8	48.2	0	0	0	0	121.3
855	S	34.7	Very low	32.7	Very low	100 Å²	100	122.6 Å²	122.6	70%	0.699	72%	0.723	S	S	*	*			cis	-170.5	160	-7.1	46.9	0	0	0	0	113.5
856	S	35	Very low	32.6	Very low	109 Å²	109	126.2 Å²	126.2	76%	0.762	73%	0.725	S	S	*	*			trans	63.4	145.7	158.1	52.7	0	0	0	0	119.4
857	S	34.6	Very low	32.5	Very low	116 Å²	116	122.3 Å²	122.3	81%	0.811	71%	0.714	S	S	*	*			cis	-155.9	168.5	-3.7	-103.7	0	0	0	0	111.2
858	P	38.3	Very low	32.1	Very low	98 Å²	98	122.9 Å²	122.9	64%	0.636	72%	0.716	S	S	*	*			trans	-126.3	-154.1	-141.6	45.6	-33.6	0	0	0	116.5
859	H	35.3	Very low	32.1	Very low	163 Å²	163	120.6 Å²	120.6	76%	0.755	70%	0.704	S	S	*	*			trans	98.1	136.2	174.4	-55.6	-66.3	0	0	0	115
860	I	33.4	Very low	31.9	Very low	133 Å²	133	121.1 Å²	121.1	68%	0.682	70%	0.698	S	S	*	*			cis	-157.8	144.6	5.4	-128.8	165.2	0	0	0	111.3
861	I	32.1	Very low	32	Very low	138 Å²	138	122.9 Å²	122.9	71%	0.708	70%	0.699	S	S	*	*			trans	46.4	124.7	149.3	-63.2	166.8	0	0	0	117.4
862	N	32.8	Very low	31.5	Very low	137 Å²	137	125 Å²	125	73%	0.733	71%	0.705	S	S	*	*			cis	-170.9	174.5	27.8	-117.2	3.7	0	0	0	108.7
863	T	30.4	Very low	31.7	Very low	91 Å²	91	123.1 Å²	123.1	56%	0.558	70%	0.702	S	S	*	*			cis	-172.3	125.2	-29.9	-108.6	0	0	0	0	111.6
864	Y	31.6	Very low	31.5	Very low	198 Å²	198	123.5 Å²	123.5	78%	0.776	71%	0.709	S	S	*	*			trans	50.1	164	152.3	-63.5	-112.2	0	0	0	122.6	Y866	Y864-Y866 HydrophobicContact CD1-CE2 4.32Å
865	A	28.2	Very low	31.5	Very low	65 Å²	65	123.1 Å²	123.1	54%	0.537	71%	0.707	S	S	.	*			cis	179.8	167.9	-43.8	0	0	0	0	0	111.3
866	Y	29.1	Very low	31.3	Very low	194 Å²	194	126.6 Å²	126.6	76%	0.761	71%	0.712	S	S	*	*			trans	67.1	131.3	165.7	-48.7	-68.3	0	0	0	117.4	Y864	Y864-Y866 HydrophobicContact CD1-CE2 4.32Å
867	T	25.5	Very low	30.9	Very low	110 Å²	110	128.3 Å²	128.3	68%	0.675	71%	0.712	S	S	*	*			cis	88.9	142	22	75.4	0	0	0	0	117.2
868	T	26.8	Very low	30.7	Very low	120 Å²	120	132.8 Å²	132.8	74%	0.736	72%	0.717	S	S	*	*			trans	72.6	151.5	165.3	64.6	0	0	0	0	117.2
869	N	28.7	Very low	30.1	Very low	126 Å²	126	136.3 Å²	136.3	67%	0.674	73%	0.725	S	S	*	*			cis	-159.8	151.7	-1	-118.8	-3.2	0	0	0	114.7
870	I	28.1	Very low	30.3	Very low	114 Å²	114	133.3 Å²	133.3	59%	0.585	72%	0.72	S	S	*	*			trans	42.9	120.9	137.4	-56.5	165.7	0	0	0	121.5
871	N	32.1	Very low	30.3	Very low	141 Å²	141	134.2 Å²	134.2	75%	0.754	72%	0.721	S	S	*	*				173.1	121.9	121.2	-92.8	-60.9	0	0	0	108.6
872	N	29	Very low	30.4	Very low	146 Å²	146	134.6 Å²	134.6	78%	0.781	72%	0.723	S	S	*	*				91.8	130.2	61.9	-80.9	-32.1	0	0	0	114.1
873	G	32.4	Very low	30.5	Very low	66 Å²	66	133.8 Å²	133.8	68%	0.68	72%	0.719	S	S	*	*			trans	112.1	96.3	-177.2	0	0	0	0	0	112
874	S	30.2	Very low	30.6	Very low	123 Å²	123	136.5 Å²	136.5	86%	0.86	73%	0.725	S	S	*	*				71.7	131.1	80.5	-61.4	0	0	0	0	113.7
875	S	33.1	Very low	30.5	Very low	98 Å²	98	132 Å²	132	69%	0.685	72%	0.722	S	S	*	*			cis	-169.6	148	-2.8	44.2	0	0	0	0	111.8
876	E	29.7	Very low	30.5	Very low	173 Å²	173	134 Å²	134	81%	0.808	73%	0.729	S	S	*	*			trans	43.5	113.6	145.5	-60.6	-173	117.4	0	0	120.2
877	L	26.9	Very low	30.6	Very low	145 Å²	145	132.5 Å²	132.5	76%	0.759	73%	0.732	S	S	*	*				70	114.2	76.5	-77.4	167.4	0	0	0	116.1
878	K	31.5	Very low	30.8	Very low	210 Å²	210	133.6 Å²	133.6	91%	0.913	74%	0.739	S	S	*	*				-166.2	136.3	123.8	-105.6	156.4	-172.9	171.2	0	113.7
879	Q	25.5	Very low	30.7	Very low	171 Å²	171	135.4 Å²	135.4	80%	0.799	74%	0.742	S	S	*	*			trans	-106.2	-161.9	165.4	-46.7	171.7	-59.7	0	0	107.1
880	P	39.1	Very low	30.7	Very low	101 Å²	101	137.2 Å²	137.2	66%	0.656	75%	0.746	S	S	*	*			cis	-122.7	-127.3	-14.1	23.8	3.3	0	0	0	110.2
881	E	33.7	Very low	30.8	Very low	151 Å²	151	137 Å²	137	71%	0.706	75%	0.746	S	S	*	*			cis	-166.6	172.1	0.1	-144.9	169.3	-126.5	0	0	111.1
882	I	35.1	Very low	30.6	Very low	146 Å²	146	133.5 Å²	133.5	75%	0.749	74%	0.743	S	S	*	*			trans	66.6	136.2	156.8	-73.6	152.9	0	0	0	120
883	D	33.6	Very low	30.6	Very low	121 Å²	121	132.8 Å²	132.8	65%	0.647	74%	0.739	S	S	*	*			cis	-166.8	173.1	-30.4	-153.8	0	0	0	0	112.4
884	Q	33.2	Very low	30.3	Very low	148 Å²	148	135 Å²	135	69%	0.692	74%	0.739	S	S	*	*			trans	72.2	95.2	150	-79.4	158.8	59.3	0	0	122.3
885	S	30.3	Very low	30.3	Very low	102 Å²	102	136.4 Å²	136.4	71%	0.713	74%	0.737	S	S	*	*				49.6	139.4	118.5	69.6	0	0	0	0	121.4
886	T	28.1	Very low	30.2	Very low	109 Å²	109	140 Å²	140	67%	0.669	74%	0.74	S	S	*	*			cis	-159.7	128.9	39.9	-49.7	0	0	0	0	113.2
887	I	29.9	Very low	30.2	Very low	161 Å²	161	140.4 Å²	140.4	83%	0.826	74%	0.742	S	S	*	*			trans	43.8	93	160.6	-53.9	167.6	0	0	0	116.6
888	T	29.2	Very low	30.4	Very low	134 Å²	134	139 Å²	139	82%	0.822	74%	0.736	S	S	*	*			trans	-151.1	159.9	161.7	-54.7	0	0	0	0	110.5	H890	T888-H890 PolarHBondContact O-N 2.97Å
889	I	24.8	Very low	30.2	Very low	158 Å²	158	136.5 Å²	136.5	81%	0.81	73%	0.727	S	S	*	*			trans	-57.9	112.1	-172.9	-57.3	158	0	0	0	113.1
890	H	28.5	Very low	30.5	Very low	164 Å²	164	136.9 Å²	136.9	76%	0.759	73%	0.729	S	S	*	*			trans	-172.5	160.9	162.5	-109.7	43.4	0	0	0	108.9	T888	T888-H890 PolarHBondContact O-N 2.97Å
891	N	32.1	Very low	29.9	Very low	109 Å²	109	140.1 Å²	140.1	58%	0.583	74%	0.735	S	S	*	*			cis	-168.4	166	-34.2	-133.1	-12.6	0	0	0	107.6	L893	N891-L893 HydrophobicContact CB-CD1 4.19Å; N891-L893 HydrophobicContact CB-CG 4.12Å
892	G	27.5	Very low	29.7	Very low	67 Å²	67	141.9 Å²	141.9	69%	0.691	74%	0.741	S	S	*	*			trans	173.3	48.8	177.8	0	0	0	0	0	111.6
893	L	28.4	Very low	29.3	Very low	132 Å²	132	141.7 Å²	141.7	69%	0.691	74%	0.74	S	S	*	*				57.3	118.8	91.4	-62	169.8	0	0	0	111.2	N891	N891-L893 HydrophobicContact CB-CD1 4.19Å; N891-L893 HydrophobicContact CB-CG 4.12Å
894	T	27.1	Very low	28.9	Very low	112 Å²	112	145 Å²	145	69%	0.687	75%	0.753	S	S	*	*			cis	-123.8	131.1	31.2	57.4	0	0	0	0	114.4
895	N	29.4	Very low	28.7	Very low	153 Å²	153	146.3 Å²	146.3	82%	0.818	76%	0.757	S	S	*	*			trans	-80.8	110.5	146.6	-150.5	-7	0	0	0	105.7
896	K	31	Very low	28.5	Very low	173 Å²	173	145.8 Å²	145.8	75%	0.752	75%	0.754	S	S	*	*			trans	-120.9	69.9	175.6	-106.6	-167.4	176.3	-171.2	0	110.7	D898	K896-D898 PolarHBondContact O-N 3.45Å
897	Q	29.2	Very low	28.5	Very low	181 Å²	181	149 Å²	149	85%	0.846	77%	0.766	S	S	*	*			trans	-71.6	77.1	147.7	-76.2	-170.4	-24.1	0	0	108.4
898	D	31.5	Very low	28.3	Very low	117 Å²	117	146.6 Å²	146.6	63%	0.626	76%	0.763	S	S	*	*			trans	-156.4	127.1	156.4	-118	-24.9	0	0	0	114.1	K896	K896-D898 PolarHBondContact O-N 3.45Å
899	Q	28.3	Very low	28.5	Very low	156 Å²	156	144.6 Å²	144.6	73%	0.729	75%	0.754	S	S	*	*			trans	43.1	102.5	147.3	-66.6	168.5	71.2	0	0	119.1
900	H	29.8	Very low	28.7	Very low	179 Å²	179	142.5 Å²	142.5	83%	0.829	75%	0.754	S	S	*	*				-141.6	113.1	102.1	-115.6	-74.4	0	0	0	112.3
901	Q	27.7	Very low	28.8	Very low	169 Å²	169	140.7 Å²	140.7	79%	0.79	75%	0.754	S	S	*	*			trans	-74.4	166.6	144.9	-67.6	-175.4	15.2	0	0	108.4
902	F	28.5	Very low	28.6	Very low	189 Å²	189	140 Å²	140	83%	0.829	76%	0.758	S	S	*	*			trans	119.4	112.8	-179.6	-88	-99.2	0	0	0	109
903	I	28.3	Very low	28.9	Very low	142 Å²	142	143 Å²	143	73%	0.728	76%	0.764	S	S	*	*			cis	-132.9	129.1	-2.8	-63.2	174.4	0	0	0	109.7
904	M	24.2	Very low	29	Very low	189 Å²	189	142.7 Å²	142.7	93%	0.931	77%	0.767	S	S	*	*			trans	-146.5	82.5	157.9	-113.5	-68.3	-102.8	0	0	108.2
905	K	28.4	Very low	29.3	Very low	176 Å²	176	143 Å²	143	77%	0.765	77%	0.771	S	S	*	*			trans	-159.2	105.7	176.2	-113.1	177.4	-177.3	179.9	0	112.6
906	S	26.2	Very low	29.5	Very low	92 Å²	92	144.2 Å²	144.2	64%	0.643	78%	0.776	S	S	*	*			trans	33.3	101.7	134.8	60.9	0	0	0	0	118.8
907	L	28.8	Very low	29.5	Very low	177 Å²	177	141.1 Å²	141.1	93%	0.927	78%	0.777	S	S	*	*			trans	-113.1	91.6	139.2	-83.8	172.2	0	0	0	108
908	S	26.2	Very low	30.1	Very low	109 Å²	109	138.2 Å²	138.2	76%	0.762	77%	0.773	S	S	*	*			trans	-136.3	72.1	-179.6	60.6	0	0	0	0	109.9
909	S	32.2	Very low	30.2	Very low	92 Å²	92	138.2 Å²	138.2	64%	0.643	78%	0.783	S	S	*	*			trans	-146.5	96.9	174.4	53.3	0	0	0	0	107.3
910	S	28.7	Very low	30.4	Very low	114 Å²	114	135.6 Å²	135.6	80%	0.797	78%	0.782	S	S	*	*				100.1	61.7	66.9	65.5	0	0	0	0	113.2
911	T	31.9	Very low	30.6	Very low	126 Å²	126	132.3 Å²	132.3	77%	0.773	78%	0.779	S	S	*	*			trans	-158.9	103.3	152.9	42.5	0	0	0	0	106.3
912	S	27.7	Very low	30.8	Very low	94 Å²	94	128.6 Å²	128.6	66%	0.657	77%	0.771	S	S	*	*				73.1	125.2	70.8	72.7	0	0	0	0	113.9
913	T	33.1	Very low	31.1	Very low	132 Å²	132	128.5 Å²	128.5	81%	0.81	77%	0.771	S	S	*	*			trans	68.2	143.4	176.3	75.3	0	0	0	0	115.7
914	T	31.6	Very low	31.2	Very low	125 Å²	125	126.2 Å²	126.2	77%	0.767	77%	0.767	S	S	*	*			cis	-156.5	155.3	-24.6	13.3	0	0	0	0	107.7
915	P	32.3	Very low	31.6	Very low	119 Å²	119	122.6 Å²	122.6	77%	0.773	76%	0.761	S	S	*	*			trans	-83.4	152.6	-179.1	34.8	-35.2	0	0	0	113
916	L	34.1	Very low	31.9	Very low	177 Å²	177	123.1 Å²	123.1	93%	0.927	77%	0.766	S	S	*	*			trans	-164.6	166.7	152.3	-109.4	165.1	0	0	0	110.6
917	S	31.8	Very low	32.4	Very low	109 Å²	109	123.1 Å²	123.1	76%	0.762	76%	0.764	S	S	*	*			trans	-131.3	-149.9	-163.8	54.8	0	0	0	0	113.1
918	P	41.1	Very low	32.6	Very low	119 Å²	119	122.6 Å²	122.6	77%	0.773	76%	0.756	S	S	*	*				-125.7	160.4	-115.2	38.8	-20.8	0	0	0	117
919	S	33.4	Very low	32.8	Very low	117 Å²	117	123.9 Å²	123.9	82%	0.818	75%	0.754	S	S	*	*			trans	-177.5	161.9	164.6	49.2	0	0	0	0	111.2
920	S	31.8	Very low	32.7	Very low	102 Å²	102	129.6 Å²	129.6	71%	0.713	76%	0.763	S	S	*	*			cis	-174.9	-175.9	-30.8	64.2	0	0	0	0	108.7
921	S	34.5	Very low	32.8	Very low	110 Å²	110	128.8 Å²	128.8	77%	0.769	76%	0.757	S	S	*	*			trans	74.5	156.2	166.3	79.8	0	0	0	0	118.8
922	S	32.8	Very low	32.7	Very low	90 Å²	90	128.5 Å²	128.5	63%	0.629	76%	0.76	S	S	*	*				-172.5	-179.8	-56.9	46	0	0	0	0	111.5
923	F	34	Very low	32.6	Very low	188 Å²	188	129.2 Å²	129.2	83%	0.825	77%	0.765	S	S	*	*			trans	81.6	149.6	174.3	-60.8	-85.9	0	0	0	118
924	S	30.8	Very low	32.5	Very low	93 Å²	93	128.4 Å²	128.4	65%	0.65	77%	0.765	S	S	*	*				-176.1	165.5	-61	51.1	0	0	0	0	112.2
925	S	33.3	Very low	32.2	Very low	113 Å²	113	127.7 Å²	127.7	79%	0.79	77%	0.765	S	S	*	*			trans	74.8	146.6	161.4	78.4	0	0	0	0	118.2
926	Q	33.5	Very low	32.4	Very low	188 Å²	188	127.8 Å²	127.8	88%	0.879	77%	0.766	S	S	*	*			cis	-154.6	172.7	-26.6	-111.4	-143.3	-28.2	0	0	109.8
927	P	36.9	Very low	32.1	Very low	92 Å²	92	127.8 Å²	127.8	60%	0.597	77%	0.766	S	S	*	*			trans	-106.3	-179.7	-154.5	42.3	-39.1	0	0	0	116.1
928	H	33.6	Very low	31.8	Very low	166 Å²	166	131.8 Å²	131.8	77%	0.769	77%	0.77	S	S	*	*				-174	135.8	124.3	-98.4	-67.9	0	0	0	113.8
929	L	30	Very low	31.1	Very low	136 Å²	136	136.7 Å²	136.7	71%	0.712	77%	0.774	S	S	*	*			trans	51.6	124.5	149.2	-54.4	168.1	0	0	0	119.1
930	Y	30.8	Very low	30.9	Very low	212 Å²	212	139.1 Å²	139.1	83%	0.831	77%	0.77	S	S	*	*			cis	-152.9	174.9	48.9	-114.4	-86	0	0	0	114.6
931	S	29.6	Very low	30.7	Very low	97 Å²	97	141.4 Å²	141.4	68%	0.678	77%	0.769	S	S	*	*			trans	-54.2	159.7	177.9	53.4	0	0	0	0	117.3
932	S	30.4	Very low	30.3	Very low	119 Å²	119	142.2 Å²	142.2	83%	0.832	77%	0.765	S	S	*	*			cis	-160.4	161	-2.9	36.7	0	0	0	0	111.6
933	S	26.3	Very low	30.3	Very low	110 Å²	110	145.2 Å²	145.2	77%	0.769	77%	0.774	S	S	*	*			trans	-153.4	134.2	-174.8	59.2	0	0	0	0	114.5
934	S	30	Very low	30.1	Very low	115 Å²	115	145.7 Å²	145.7	80%	0.804	78%	0.776	S	S	*	*			trans	-164.1	131	153.7	48	0	0	0	0	108.3
935	S	25.1	Very low	30	Very low	110 Å²	110	148 Å²	148	77%	0.769	78%	0.779	S	S	*	*			cis	83.8	136.6	15.8	-41.4	0	0	0	0	115.4
936	P	35.9	Very low	29.7	Very low	121 Å²	121	149.5 Å²	149.5	79%	0.786	78%	0.777	S	S	*	*			trans	-116.9	153.9	-153.1	39.6	-26.8	0	0	0	115.1
937	L	27.8	Very low	29.8	Very low	176 Å²	176	148.9 Å²	148.9	92%	0.921	77%	0.774	S	S	*	*			trans	-140.9	155.6	175.4	-79.9	179	0	0	0	114.8
938	K	25.5	Very low	29.3	Very low	194 Å²	194	148.8 Å²	148.8	84%	0.843	78%	0.775	S	S	*	*			trans	-92.2	136.4	175.8	-52.2	158.3	178.1	169.7	0	110.2
939	Y	28.1	Very low	29.3	Very low	221 Å²	221	149.4 Å²	149.4	87%	0.867	78%	0.783	S	S	*	*			trans	-154.7	130.1	144.4	-88.8	-80.1	0	0	0	105.6
940	K	28.7	Very low	29.3	Very low	169 Å²	169	152.3 Å²	152.3	74%	0.735	79%	0.79	S	S	*	*			cis	84.9	80.9	29.8	-146.6	-161.9	-174.6	-161.6	0	114.9
941	Q	27.5	Very low	29.4	Very low	149 Å²	149	147.8 Å²	147.8	70%	0.696	79%	0.787	S	S	*	*			trans	72.8	147.8	139.7	-87.2	-179.1	-95.8	0	0	123.2
942	D	26.2	Very low	29.5	Very low	127 Å²	127	153.5 Å²	153.5	68%	0.679	80%	0.8	S	S	*	*			trans	80.6	159.2	156.5	-52.9	-25.1	0	0	0	119.4
943	N	32.4	Very low	29.7	Very low	153 Å²	153	155.6 Å²	155.6	82%	0.818	80%	0.797	S	S	*	*			trans	72.3	114.1	-158.8	-53.6	-31.5	0	0	0	113.7
944	K	28.8	Very low	30.1	Very low	198 Å²	198	156.1 Å²	156.1	86%	0.861	80%	0.797	S	S	*	*			cis	70.5	145.7	17	-130.3	-177.9	-173.4	-175.8	0	113.9
945	I	29.3	Very low	30.2	Very low	142 Å²	142	159 Å²	159	73%	0.728	80%	0.795	S	S	*	*			trans	74.8	104.4	-166.2	-51.8	167.1	0	0	0	110.3
946	I	27.7	Very low	30.7	Very low	144 Å²	144	159.6 Å²	159.6	74%	0.738	79%	0.794	S	S	*	*				71.7	88.8	60.4	-54.4	168.8	0	0	0	113.2
947	H	34.6	Very low	30.6	Very low	175 Å²	175	161.3 Å²	161.3	81%	0.81	79%	0.792	S	S	*	*			trans	-153.8	123.6	144.8	-91.1	-72.3	0	0	0	106.7
948	S	27.8	Very low	30.9	Very low	90 Å²	90	159.2 Å²	159.2	63%	0.629	78%	0.782	S	S	*	*			cis	78	66.4	37.6	86.3	0	0	0	0	114.9
949	L	32.7	Very low	31.2	Very low	179 Å²	179	155.9 Å²	155.9	94%	0.937	78%	0.778	S	S	*	*			trans	-119.3	149.3	157.7	-75.4	174.6	0	0	0	110.4
950	K	30.5	Very low	31.5	Very low	198 Å²	198	148.2 Å²	148.2	86%	0.861	77%	0.766	S	S	*	*	P	Polyproline II helix	trans	-94.7	160.2	-159.5	-79.1	-177.4	175.3	-177.4	0	114.2
951	P	32.5	Very low	31.6	Very low	117 Å²	117	151 Å²	151	76%	0.76	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-71.6	166.3	172	32.6	-37.7	0	0	0	112.6
952	F	32.3	Very low	31.7	Very low	216 Å²	216	148.4 Å²	148.4	95%	0.947	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-89.9	141.9	166.3	-106.1	-97.6	0	0	0	110.9
953	E	34.1	Very low	32	Very low	164 Å²	164	149.3 Å²	149.3	77%	0.766	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-93.9	154.5	-170.6	-61.4	-178	152	0	0	114.1
954	P	35	Very low	31.7	Very low	120 Å²	120	146.1 Å²	146.1	78%	0.779	77%	0.765	S	S	*	*			trans	-104.3	145.5	170	37.7	-30.9	0	0	0	113.9
955	F	32.6	Very low	31.9	Very low	176 Å²	176	145 Å²	145	77%	0.772	76%	0.762	S	S	*	*			trans	-144.4	149.7	163.5	-86.5	-91.6	0	0	0	106.8
956	T	34.7	Very low	31.8	Very low	122 Å²	122	142.6 Å²	142.6	75%	0.748	76%	0.759	S	S	*	*			cis	-137.1	165.4	22.7	51.4	0	0	0	0	114.8
957	Q	33.5	Very low	31.9	Very low	158 Å²	158	144.1 Å²	144.1	74%	0.738	76%	0.762	S	S	*	*			trans	-29.9	161.3	159.5	-67.5	156.6	-10.1	0	0	117.1
958	N	33.8	Very low	31.8	Very low	131 Å²	131	144.4 Å²	144.4	70%	0.701	76%	0.764	S	S	*	*			cis	-161	160.3	41.4	-135.3	-6	0	0	0	116.7
959	T	32.6	Very low	32	Very low	124 Å²	124	148.5 Å²	148.5	76%	0.761	77%	0.773	S	S	*	*			trans	0.8	149.5	159.4	54.2	0	0	0	0	122.7
960	G	33.4	Very low	32.1	Very low	61 Å²	61	144.8 Å²	144.8	63%	0.629	76%	0.759	S	S	*	*			cis	166	-175.6	1.8	0	0	0	0	0	115
961	Y	31.9	Very low	32.1	Very low	227 Å²	227	142.9 Å²	142.9	89%	0.89	75%	0.753	S	S	*	*			trans	69.7	124.5	-178.3	-57.4	-89.6	0	0	0	116
962	S	28.7	Very low	32	Very low	94 Å²	94	144.1 Å²	144.1	66%	0.657	75%	0.748	S	S	*	*			cis	78.9	131.7	36.8	80.9	0	0	0	0	113.4
963	I	32.3	Very low	31.9	Very low	147 Å²	147	140.4 Å²	140.4	75%	0.754	73%	0.734	S	S	*	*			cis	-159.1	131.1	48.6	-72.6	176.8	0	0	0	107
964	S	26.6	Very low	31.7	Very low	86 Å²	86	138.8 Å²	138.8	60%	0.601	73%	0.73	S	S	*	*				81.4	149	71.4	116.1	0	0	0	0	117.2
965	H	32.8	Very low	31.4	Very low	173 Å²	173	139.7 Å²	139.7	80%	0.801	73%	0.728	S	S	*	*			trans	73.4	150.2	178.2	-71.1	66.3	0	0	0	117.9
966	S	28.3	Very low	31.3	Very low	93 Å²	93	138.9 Å²	138.9	65%	0.65	73%	0.732	S	S	*	*			cis	-169.2	142.7	-25.2	51.6	0	0	0	0	112.3
967	Q	28.1	Very low	31	Very low	175 Å²	175	138.4 Å²	138.4	82%	0.818	73%	0.733	S	S	*	*			trans	24.2	129.4	152.6	-62.6	177.5	-18.3	0	0	121.5
968	H	33.2	Very low	30.7	Very low	182 Å²	182	138.3 Å²	138.3	84%	0.843	74%	0.738	S	S	*	*				-163.5	169.9	111	-112.9	-78.4	0	0	0	114.1
969	H	32.4	Very low	30.5	Very low	176 Å²	176	136.2 Å²	136.2	82%	0.815	73%	0.733	S	S	*	*			trans	-77.4	176.5	-165.9	-97	-71.1	0	0	0	116.3
970	P	34.7	Very low	30.3	Very low	100 Å²	100	138.2 Å²	138.2	65%	0.649	73%	0.731	S	S	*	*			trans	-116.4	-160.4	-157.9	45.2	-35.9	0	0	0	114.4
971	H	30.4	Very low	30	Very low	158 Å²	158	144.1 Å²	144.1	73%	0.731	74%	0.735	S	S	*	*			trans	117.5	129.7	159.7	-86.4	-83.8	0	0	0	118.3
972	H	30.9	Very low	30	Very low	143 Å²	143	139.8 Å²	139.8	66%	0.662	73%	0.727	S	S	*	*			trans	80.5	128.3	146	-81.9	-65.3	0	0	0	123.7
973	H	30.3	Very low	30.1	Very low	138 Å²	138	140.2 Å²	140.2	64%	0.639	73%	0.73	S	S	*	*			trans	75	102.3	148.4	-70.9	-63.3	0	0	0	122.2
974	D	29.3	Very low	30	Very low	131 Å²	131	142.2 Å²	142.2	70%	0.701	74%	0.736	S	S	*	*				86.4	153.1	119.4	-57.7	-6.3	0	0	0	122.8
975	D	29.5	Very low	30.4	Very low	138 Å²	138	143.5 Å²	143.5	74%	0.738	75%	0.745	S	S	*	*			trans	60.7	97.6	164.1	-66.6	-16.2	0	0	0	122.1
976	L	29.9	Very low	30.3	Very low	160 Å²	160	142.1 Å²	142.1	84%	0.838	74%	0.744	S	S	*	*				44.8	105	115.8	-68.2	166.7	0	0	0	118.7
977	S	28.7	Very low	30.5	Very low	111 Å²	111	144.8 Å²	144.8	78%	0.776	75%	0.75	S	S	*	*				-167	145.6	127.1	15.3	0	0	0	0	113.2
978	D	27.8	Very low	30.6	Very low	157 Å²	157	142.5 Å²	142.5	84%	0.84	74%	0.743	S	S	*	*				20	136.4	128	-66.1	-6.7	0	0	0	118.9
979	S	28.1	Very low	30.5	Very low	86 Å²	86	141.2 Å²	141.2	60%	0.601	74%	0.742	S	S	*	*			cis	-177.7	156.2	9.1	53.1	0	0	0	0	113.3
980	K	28.1	Very low	30.3	Very low	167 Å²	167	138.5 Å²	138.5	73%	0.726	73%	0.732	S	S	*	*				64.5	175	128.5	-172.1	-178.6	170.6	-166.1	0	118.7
981	W	28.7	Very low	30.3	Very low	184 Å²	184	138.7 Å²	138.7	70%	0.697	74%	0.736	S	S	*	*			trans	74	126.6	172.9	-46.1	87.2	0	0	0	112.8
982	D	31.2	Very low	30.4	Very low	136 Å²	136	139.1 Å²	139.1	73%	0.727	74%	0.738	S	S	*	*			cis	-145.7	162.5	1.7	-96.9	-35.1	0	0	0	115.4
983	S	31.5	Very low	30.4	Very low	103 Å²	103	139.1 Å²	139.1	72%	0.72	74%	0.742	S	S	*	*			trans	-104.7	156.2	173	53.1	0	0	0	0	111.3
984	E	30.3	Very low	30.3	Very low	189 Å²	189	137.9 Å²	137.9	88%	0.883	74%	0.744	S	S	*	*			trans	-162.4	170.4	149.4	-126.4	177.2	-158.7	0	0	115
985	S	34.4	Very low	30.3	Very low	114 Å²	114	138.9 Å²	138.9	80%	0.797	74%	0.744	S	S	*	*			trans	80.8	72.1	174.2	66.6	0	0	0	0	118.9
986	D	30.3	Very low	30.2	Very low	143 Å²	143	139.7 Å²	139.7	77%	0.765	75%	0.747	S	S	*	*			trans	-58.5	178.8	151.1	-49.2	-98.6	0	0	0	112
987	L	32.9	Very low	30	Very low	150 Å²	150	136.9 Å²	136.9	79%	0.785	74%	0.741	S	S	*	*				-160.8	128.1	75.2	-80.1	169.3	0	0	0	112.1
988	L	31.1	Very low	30	Very low	126 Å²	126	137.9 Å²	137.9	66%	0.66	74%	0.742	S	S	*	*			trans	55.8	142.4	135	-58.2	179.5	0	0	0	119.5	I990	L988-I990 HydrophobicContact CD2-CD1 4.03Å; L988-I990 HydrophobicContact CD2-CG1 4.38Å
989	N	30.4	Very low	29.9	Very low	155 Å²	155	137.7 Å²	137.7	83%	0.829	74%	0.741	S	S	*	*			cis	-139.8	159.1	39.8	-145.5	2.7	0	0	0	114.7
990	I	28.8	Very low	29.9	Very low	120 Å²	120	138.7 Å²	138.7	62%	0.615	75%	0.748	S	S	*	*			trans	-123.4	143.9	-164.4	-65.2	167.1	0	0	0	111.3	L988 I993	L988-I990 HydrophobicContact CD2-CD1 4.03Å; L988-I990 HydrophobicContact CD2-CG1 4.38Å; I990-I993 HydrophobicContact CG2-CD1 4.28Å
991	S	33.6	Very low	30	Very low	103 Å²	103	139.9 Å²	139.9	72%	0.72	76%	0.758	S	S	*	*			trans	-148.9	96.8	147.9	60.1	0	0	0	0	110.9
992	E	33.4	Very low	30.1	Very low	168 Å²	168	137.9 Å²	137.9	79%	0.785	76%	0.761	S	S	*	*			trans	64.4	114.9	142.7	-62.3	162.6	158.5	0	0	118
993	I	29.8	Very low	30	Very low	143 Å²	143	139.5 Å²	139.5	73%	0.733	77%	0.77	S	S	*	*			cis	67.9	127.2	40.5	-44.6	163.7	0	0	0	109.9	I990	I990-I993 HydrophobicContact CG2-CD1 4.28Å
994	T	28.2	Very low	30	Very low	111 Å²	111	137.9 Å²	137.9	68%	0.681	77%	0.769	S	S	*	*			cis	-117.3	-175.5	27.5	59.2	0	0	0	0	113
995	E	28.7	Very low	30.1	Very low	153 Å²	153	136.7 Å²	136.7	72%	0.715	77%	0.769	S	S	*	*			cis	-155.7	124.5	14.5	-152.6	146	-90.4	0	0	115
996	I	27.4	Very low	29.7	Very low	155 Å²	155	140 Å²	140	80%	0.795	77%	0.77	S	S	*	*			trans	54.7	136.5	140.5	-62.2	173	0	0	0	121.7
997	S	26.2	Very low	29.6	Very low	100 Å²	100	142.3 Å²	142.3	70%	0.699	77%	0.773	S	S	*	*			trans	-84.5	-176.1	174.6	57.6	0	0	0	0	113.3
998	V	29.8	Very low	29.3	Very low	132 Å²	132	144.7 Å²	144.7	80%	0.8	78%	0.777	S	S	*	*				-154.1	144.9	82.9	169.1	0	0	0	0	110.4
999	N	26	Very low	29.3	Very low	153 Å²	153	146.1 Å²	146.1	82%	0.818	78%	0.783	S	S	*	*			trans	-97	145.8	171.1	-91.5	-32	0	0	0	112.6
1000	S	27.4	Very low	29.1	Very low	108 Å²	108	146.2 Å²	146.2	76%	0.755	78%	0.781	S	S	*	*			trans	55.4	112.3	146.5	173.1	0	0	0	0	120
1001	M	30.3	Very low	29	Very low	192 Å²	192	146.5 Å²	146.5	95%	0.946	78%	0.783	S	S	*	*			trans	-148.8	151.6	137.7	-110.8	175	-174.6	0	0	111.2
1002	N	31.1	Very low	28.9	Very low	141 Å²	141	149.3 Å²	149.3	75%	0.754	79%	0.79	S	S	*	*			trans	-93.2	172.7	-171.9	-85.9	-6.8	0	0	0	113.7
1003	D	29.3	Very low	28.7	Very low	170 Å²	170	146.7 Å²	146.7	91%	0.909	78%	0.781	S	S	*	*			trans	-51.7	141.7	-177.2	-62.2	-75.8	0	0	0	116.3
1004	G	31	Very low	28.9	Very low	69 Å²	69	147.1 Å²	147.1	71%	0.711	78%	0.78	S	S	*	*			trans	-177.4	121.7	166.7	0	0	0	0	0	114.2
1005	N	32.6	Very low	28.9	Very low	164 Å²	164	150.2 Å²	150.2	88%	0.877	78%	0.784	S	S	*	*			trans	62.1	76.1	161	-62.6	-28.2	0	0	0	120.1
1006	F	25.8	Very low	29.1	Very low	184 Å²	184	147.7 Å²	147.7	81%	0.807	78%	0.782	S	S	*	*				30.5	117.4	121.7	-100.1	-105.5	0	0	0	121.2
1007	K	27.5	Very low	29.4	Very low	191 Å²	191	146.2 Å²	146.2	83%	0.83	78%	0.776	S	S	*	*			trans	43.1	78.7	135.6	-65.6	-173.1	177	179.2	0	119.1
1008	K	27.6	Very low	29.6	Very low	201 Å²	201	149 Å²	149	87%	0.874	78%	0.781	S	S	*	*			trans	-161.2	131.3	146.2	-106.7	174.8	-177	176.6	0	106.1
1009	I	30.9	Very low	29.8	Very low	155 Å²	155	145.7 Å²	145.7	80%	0.795	77%	0.774	S	S	*	*			cis	-138.7	152	14.6	-81.7	145.6	0	0	0	109.6
1010	M	25.8	Very low	29.9	Very low	157 Å²	157	147.1 Å²	147.1	77%	0.773	78%	0.776	S	S	*	*			trans	-91	153.5	168.1	-91.3	-149.3	-61.7	0	0	112.2
1011	N	26.5	Very low	30.1	Very low	126 Å²	126	148.5 Å²	148.5	67%	0.674	78%	0.779	S	S	*	*			trans	65.6	127.6	160.5	-61.7	-27.6	0	0	0	118.4
1012	L	31.9	Very low	30	Very low	162 Å²	162	147.2 Å²	147.2	85%	0.848	77%	0.771	S	S	*	*				179	103	115.8	-89.2	158.6	0	0	0	106.6
1013	N	28.4	Very low	29.8	Very low	114 Å²	114	146.3 Å²	146.3	61%	0.61	77%	0.765	S	S	*	*				88.7	135.8	72.9	-104	-24.4	0	0	0	114.9
1014	H	34.5	Very low	29.8	Very low	152 Å²	152	144.5 Å²	144.5	70%	0.704	75%	0.751	S	S	*	*			trans	76	143.5	153.8	-62	-9.1	0	0	0	118.3
1015	K	29	Very low	29.8	Very low	175 Å²	175	147.5 Å²	147.5	76%	0.761	75%	0.747	S	S	*	*			cis	-168.2	-178.1	-21.7	-138.5	176.8	-179.7	-179.9	0	110.4
1016	C	32.3	Very low	29.6	Very low	101 Å²	101	147.5 Å²	147.5	68%	0.682	74%	0.739	S	S	*	*			trans	80.1	142.3	166.2	-58.1	0	0	0	0	117.8
1017	N	33.5	Very low	30	Very low	123 Å²	123	144.3 Å²	144.3	66%	0.658	74%	0.737	S	S	*	*			cis	-160.2	125.7	-20	-107.2	-1.7	0	0	0	108.6
1018	I	29.9	Very low	30.1	Very low	158 Å²	158	141 Å²	141	81%	0.81	73%	0.733	S	S	*	*				81.4	131.5	96.9	-67.6	178.9	0	0	0	116.2
1019	G	34.1	Very low	30.1	Very low	64 Å²	64	138 Å²	138	66%	0.66	73%	0.726	S	S	*	*			trans	112.2	103.6	177.5	0	0	0	0	0	111.9
1020	Q	28.7	Very low	29.9	Very low	182 Å²	182	137.1 Å²	137.1	85%	0.85	72%	0.72	S	S	*	*			cis	55.6	131.5	45.7	-67.1	-174.9	-39.3	0	0	112.1
1021	V	31	Very low	30	Very low	137 Å²	137	137.7 Å²	137.7	83%	0.83	72%	0.723	S	S	*	*			cis	-141	146.7	43.3	171.4	0	0	0	0	114.7
1022	E	27.6	Very low	30	Very low	165 Å²	165	139.1 Å²	139.1	77%	0.771	73%	0.731	S	S	*	*			trans	-36.8	174.7	157.7	-101.1	167.5	176.5	0	0	118.1
1023	L	28.5	Very low	30.1	Very low	122 Å²	122	136.3 Å²	136.3	64%	0.639	72%	0.723	S	S	*	*			cis	-170	175.1	28.5	-128.4	172.4	0	0	0	112.6
1024	H	29	Very low	30	Very low	132 Å²	132	135.6 Å²	135.6	61%	0.611	73%	0.727	S	S	*	*			trans	69.3	117.3	154.5	-74.8	-65	0	0	0	125.3
1025	E	30.4	Very low	29.6	Very low	133 Å²	133	133.5 Å²	133.5	62%	0.621	73%	0.729	S	S	*	*				67.7	152	126.3	-62	-171.5	177.6	0	0	122.6
1026	K	28.4	Very low	29.6	Very low	163 Å²	163	131.6 Å²	131.6	71%	0.709	73%	0.732	S	S	*	*			cis	-158	156.1	-9.4	-117.5	166.1	-167.1	148.6	0	109.7
1027	P	35.2	Very low	29.2	Very low	117 Å²	117	133 Å²	133	76%	0.76	74%	0.736	S	S	*	*			trans	-107.2	147.6	178.3	37.9	-31.3	0	0	0	115
1028	T	29.1	Very low	29	Very low	122 Å²	122	134.4 Å²	134.4	75%	0.748	74%	0.742	S	S	*	*			trans	-171.2	137.7	158.6	26.2	0	0	0	0	113.2
1029	N	27.8	Very low	28.9	Very low	137 Å²	137	132.4 Å²	132.4	73%	0.733	74%	0.738	S	S	*	*			trans	63.1	152.8	139.8	-61.5	-6.5	0	0	0	120.2
1030	M	26	Very low	28.8	Very low	137 Å²	137	134.2 Å²	134.2	68%	0.675	74%	0.738	S	S	*	*			cis	-163.6	173.1	-7	-115.9	164.3	69	0	0	111.2
1031	M	29.2	Very low	28.8	Very low	169 Å²	169	130.4 Å²	130.4	83%	0.833	73%	0.731	S	S	*	*			trans	77.2	106.6	154.4	-77.1	164.9	163.5	0	0	122.2
1032	N	25.5	Very low	28.8	Very low	156 Å²	156	131.1 Å²	131.1	83%	0.834	73%	0.73	S	S	*	*			trans	-57	177.7	143.9	-102.4	-14.3	0	0	0	113.3
1033	P	34.6	Very low	28.9	Very low	104 Å²	104	130 Å²	130	68%	0.675	73%	0.728	S	S	*	*			cis	-140.5	-157.6	-20.4	32.4	-8.3	0	0	0	113.3
1034	S	26.5	Very low	28.9	Very low	99 Å²	99	130.5 Å²	130.5	69%	0.692	73%	0.731	S	S	*	*			trans	93.8	106.5	146.5	-60.3	0	0	0	0	121.8
1035	S	24.4	Very low	28.8	Very low	108 Å²	108	128.9 Å²	128.9	76%	0.755	74%	0.735	S	S	*	*			trans	33.8	119.3	131.8	63.8	0	0	0	0	121.8
1036	V	29.6	Very low	28.8	Very low	135 Å²	135	127.2 Å²	127.2	82%	0.818	74%	0.738	S	S	*	*			trans	-134.3	136.2	142.7	179.4	0	0	0	0	109	I1038	V1036-I1038 HydrophobicContact CG1-CG1 4.27Å
1037	V	24.1	Very low	28.8	Very low	129 Å²	129	124.3 Å²	124.3	78%	0.782	74%	0.738	S	S	*	*			trans	-102.5	123.8	175.5	173	0	0	0	0	109.2
1038	I	30.5	Very low	28.5	Very low	153 Å²	153	123.3 Å²	123.3	79%	0.785	73%	0.733	S	S	*	*			trans	-137.3	111.4	161.2	-54.8	-178.7	0	0	0	110.4	V1036	V1036-I1038 HydrophobicContact CG1-CG1 4.27Å
1039	T	25.8	Very low	28.4	Very low	116 Å²	116	122.5 Å²	122.5	71%	0.712	73%	0.733	S	S	*	*			trans	-119	-178.3	151.2	61.3	0	0	0	0	105.7
1040	P	32.9	Very low	28.3	Very low	102 Å²	102	120.2 Å²	120.2	66%	0.662	73%	0.728	S	S	*	*			cis	-143.5	173.6	5.1	44.9	-27.4	0	0	0	117.3
1041	S	29.5	Very low	28.3	Very low	102 Å²	102	121.3 Å²	121.3	71%	0.713	74%	0.735	S	S	*	*			trans	63.8	163.8	137.6	-67.4	0	0	0	0	123.9
1042	L	30.3	Very low	28.3	Very low	152 Å²	152	118.2 Å²	118.2	80%	0.796	73%	0.73	S	S	*	*			trans	76.8	152.7	162.4	-43.9	-175.1	0	0	0	116.6
1043	L	28.6	Very low	28.5	Very low	142 Å²	142	115.4 Å²	115.4	74%	0.743	72%	0.722	S	S	*	*			cis	-167.3	-179.4	-23.1	-100.9	-179.2	0	0	0	105.7
1044	L	28.8	Very low	28.4	Very low	133 Å²	133	116 Å²	116	70%	0.696	73%	0.726	S	S	*	*			cis	-156	163.4	5.2	-170.8	59.9	0	0	0	108.3
1045	S	27.9	Very low	28.4	Very low	98 Å²	98	116.3 Å²	116.3	69%	0.685	72%	0.724	S	S	*	*			trans	62.7	155.9	147	45.4	0	0	0	0	121.7
1046	S	31	Very low	28.5	Very low	98 Å²	98	120 Å²	120	69%	0.685	73%	0.726	S	S	*	*			cis	-173.5	169.1	-21.2	55	0	0	0	0	110.9
1047	S	27.9	Very low	28.5	Very low	102 Å²	102	119.7 Å²	119.7	71%	0.713	72%	0.72	S	S	*	*			trans	55.3	145.1	141.7	58.5	0	0	0	0	121.7
1048	S	28.2	Very low	28.5	Very low	95 Å²	95	124 Å²	124	66%	0.664	72%	0.722	S	S	*	*			cis	-177.2	173.8	-11.4	52.1	0	0	0	0	109.2
1049	S	28	Very low	28.4	Very low	106 Å²	106	124.1 Å²	124.1	74%	0.741	72%	0.723	S	S	*	*			trans	63.4	151.2	151.3	43.3	0	0	0	0	119.5
1050	S	25.8	Very low	28.3	Very low	89 Å²	89	124.8 Å²	124.8	62%	0.622	73%	0.727	S	S	*	*			cis	178.9	162.9	-16.6	54.1	0	0	0	0	109.7
1051	I	25.9	Very low	28	Very low	160 Å²	160	126.4 Å²	126.4	82%	0.821	73%	0.729	S	S	*	*			trans	69.8	141.1	155.2	-69.7	160.5	0	0	0	115.1
1052	S	27.4	Very low	27.7	Very low	104 Å²	104	131.4 Å²	131.4	73%	0.727	74%	0.738	S	S	*	*			cis	-161.2	157.8	-9	47	0	0	0	0	111.9
1053	S	30.9	Very low	27.6	Very low	96 Å²	96	129.4 Å²	129.4	67%	0.671	73%	0.732	S	S	*	*			trans	-79.8	153.7	169.1	59.3	0	0	0	0	114.2
1054	P	32.4	Very low	27.4	Very low	118 Å²	118	130.8 Å²	130.8	77%	0.766	74%	0.74	S	S	*	*				-125.9	150	112.1	3	18.3	0	0	0	111.9
1055	V	26.1	Very low	27.4	Very low	105 Å²	105	128.8 Å²	128.8	64%	0.636	74%	0.737	S	S	*	*			cis	94.2	124.3	29.4	172.8	0	0	0	0	114.1
1056	K	26.9	Very low	27.2	Very low	184 Å²	184	131.4 Å²	131.4	80%	0.8	74%	0.743	S	S	*	*			trans	71.2	151.4	173.8	-67.9	157.6	-168	170.6	0	115.4
1057	N	29	Very low	27.1	Very low	129 Å²	129	135.2 Å²	135.2	69%	0.69	75%	0.753	S	S	*	*			cis	-126.4	145.4	-1.1	-87.2	-49.4	0	0	0	108.8
1058	R	24.7	Very low	27	Very low	221 Å²	221	137.8 Å²	137.8	83%	0.834	76%	0.758	S	S	*	*				70.5	94.2	51.8	-168.9	-160.7	-166.6	-164.1	6	113.5
1059	L	27.4	Very low	27.1	Very low	155 Å²	155	136.9 Å²	136.9	81%	0.812	76%	0.764	S	S	*	*			trans	-154.3	107.1	145.4	-117.9	169.1	0	0	0	111.5	I1061	L1059-I1061 HydrophobicContact CD2-CG1 4.47Å
1060	T	23.9	Very low	27.1	Very low	129 Å²	129	141.1 Å²	141.1	79%	0.791	77%	0.769	S	S	*	*			trans	-79.8	130.5	167.9	46.4	0	0	0	0	109.7
1061	I	26.4	Very low	27.1	Very low	136 Å²	136	143.9 Å²	143.9	70%	0.697	77%	0.774	S	S	*	*			trans	-126.7	111.9	164.1	-52.3	-176.9	0	0	0	108.6	L1059 V1063	L1059-I1061 HydrophobicContact CD2-CG1 4.47Å; I1061-V1063 HydrophobicContact CG2-CG2 3.67Å
1062	K	23.6	Very low	27.2	Very low	208 Å²	208	146.6 Å²	146.6	90%	0.904	77%	0.774	S	S	*	*			trans	-77.1	129.6	158.8	-73	-179.9	174	-178.3	0	107.3
1063	V	27.9	Very low	27.1	Very low	110 Å²	110	146.1 Å²	146.1	67%	0.667	77%	0.771	S	S	*	*			trans	-123	105.7	163.1	-172.5	0	0	0	0	108.7	I1061	I1061-V1063 HydrophobicContact CG2-CG2 3.67Å
1064	N	25.2	Very low	27.1	Very low	170 Å²	170	149.9 Å²	149.9	91%	0.909	78%	0.781	S	S	*	*			trans	-87.8	114.3	161.9	-95.6	5.5	0	0	0	108.1
1065	S	29	Very low	27	Very low	91 Å²	91	151.4 Å²	151.4	64%	0.636	78%	0.778	S	S	*	*			trans	-162	98.7	166	53.7	0	0	0	0	106.5
1066	N	24	Very low	27	Very low	154 Å²	154	150.7 Å²	150.7	82%	0.824	78%	0.777	S	S	*	*			cis	59.4	76.3	47.6	-139.8	33	0	0	0	111.5
1067	M	28.2	Very low	27.1	Very low	178 Å²	178	150.9 Å²	150.9	88%	0.877	78%	0.781	S	S	*	*			trans	-144.3	133.3	157.8	-99.4	-59	173.4	0	0	110.2
1068	N	26.2	Very low	27.5	Very low	155 Å²	155	150 Å²	150	83%	0.829	78%	0.783	S	S	*	*			trans	-73.9	146.7	-164.4	-62.8	-73.6	0	0	0	114.6
1069	G	30.6	Very low	27.8	Very low	77 Å²	77	148.1 Å²	148.1	79%	0.794	79%	0.788	S	S	*	*			trans	-154.2	81	174.3	0	0	0	0	0	113.4
1070	K	26.7	Very low	27.6	Very low	195 Å²	195	148 Å²	148	85%	0.848	79%	0.787	S	S	*	*			trans	-51.2	152.7	175.6	-66.5	170.6	171.3	172.3	0	112.1
1071	M	26.3	Very low	27.8	Very low	146 Å²	146	151.6 Å²	151.6	72%	0.719	79%	0.788	S	S	*	*			cis	-151.2	157.9	37.1	-83.1	-164.5	-173.3	0	0	114.5
1072	R	29.2	Very low	27.8	Very low	218 Å²	218	152.4 Å²	152.4	82%	0.823	79%	0.789	S	S	*	*			trans	46.9	102.5	149.2	-61.1	167.5	-163.6	-102.8	6.9	116.4
1073	S	25.1	Very low	27.8	Very low	94 Å²	94	149.1 Å²	149.1	66%	0.657	78%	0.778	S	S	*	*			cis	64	104.5	26	-179.3	0	0	0	0	116
1074	I	31.1	Very low	27.7	Very low	174 Å²	174	152.3 Å²	152.3	89%	0.892	78%	0.783	S	S	*	*			trans	-134.9	133.4	138.6	-62.9	-174.9	0	0	0	107
1075	H	29.2	Very low	27.8	Very low	151 Å²	151	149.6 Å²	149.6	70%	0.699	77%	0.773	S	S	*	*			trans	-88.7	140.8	177.5	-85.5	-92.3	0	0	0	110
1076	S	27	Very low	27.7	Very low	89 Å²	89	152.4 Å²	152.4	62%	0.622	78%	0.776	S	S	*	*				72.3	124.7	64.4	89.7	0	0	0	0	116
1077	E	27.6	Very low	28.1	Very low	189 Å²	189	151.7 Å²	151.7	88%	0.883	78%	0.778	S	S	*	*			trans	83.1	158.5	157.7	-74.7	-159.2	160.6	0	0	120.7
1078	P	38.9	Very low	28.1	Very low	111 Å²	111	149.5 Å²	149.5	72%	0.721	77%	0.769	S	S	*	*			trans	-119.5	168.7	-140.2	43.5	-35.1	0	0	0	115.9
1079	L	30.1	Very low	28.7	Very low	181 Å²	181	150 Å²	150	95%	0.948	77%	0.766	S	S	*	*			trans	-142.3	159.7	167.4	-81.5	-178.3	0	0	0	115
1080	L	24.3	Very low	28.8	Very low	152 Å²	152	152 Å²	152	80%	0.796	76%	0.759	S	S	*	*			trans	-95.5	-169.8	178.9	-164.5	64.4	0	0	0	110.6
1081	Y	27.7	Very low	29.2	Very low	205 Å²	205	148.5 Å²	148.5	80%	0.804	75%	0.749	S	S	*	*			trans	79.9	127.5	-175.7	-66.3	-94.7	0	0	0	114.4
1082	Q	25.2	Very low	29.5	Very low	152 Å²	152	147.5 Å²	147.5	71%	0.71	75%	0.747	S	S	*	*			cis	88.4	122.1	10.2	-145.8	-167.6	14.9	0	0	117.2
1083	M	24.4	Very low	29.9	Very low	139 Å²	139	142.3 Å²	142.3	69%	0.685	74%	0.735	S	S	*	*			trans	83.2	126.9	163.8	-64.4	-145.5	-177.4	0	0	121.5
1084	K	26.5	Very low	30.3	Very low	177 Å²	177	143.2 Å²	143.2	77%	0.77	73%	0.733	S	S	*	*			trans	73	151.7	142.2	-70.1	178.1	179.6	-173.2	0	118.5
1085	T	26	Very low	30.4	Very low	113 Å²	113	141.1 Å²	141.1	69%	0.693	72%	0.724	S	S	*	*			cis	-151.2	178.1	-5	5.4	0	0	0	0	110.8
1086	E	26.9	Very low	30.6	Very low	150 Å²	150	138.9 Å²	138.9	70%	0.701	72%	0.717	S	S	*	*			trans	-59	157.1	170.8	-50.6	94.5	154.2	0	0	114.5
1087	T	33.2	Very low	31	Very low	140 Å²	140	141.7 Å²	141.7	86%	0.859	72%	0.72	S	S	*	*			trans	-150.2	133	135.2	47.5	0	0	0	0	109.6
1088	D	28.6	Very low	31.1	Very low	131 Å²	131	137.4 Å²	137.4	70%	0.701	71%	0.711	S	S	*	*			trans	-84.8	162.1	-176.2	-46.8	-92.1	0	0	0	114
1089	H	37.1	Very low	30.8	Very low	165 Å²	165	138.2 Å²	138.2	76%	0.764	72%	0.717	S	S	*	*				173.6	123.3	127.5	-92	-38.7	0	0	0	110
1090	D	34.7	Very low	30.7	Very low	120 Å²	120	136.5 Å²	136.5	64%	0.642	71%	0.709	S	S	*	*				69.9	138.3	95.1	-69.6	40	0	0	0	113.6
1091	N	33.2	Very low	31.3	Very low	121 Å²	121	136.7 Å²	136.7	65%	0.647	71%	0.711	S	S	*	*			cis	-166.8	155.6	-12.1	-113	-35.6	0	0	0	108.2
1092	N	33.1	Very low	31.5	Very low	125 Å²	125	135.7 Å²	135.7	67%	0.668	71%	0.714	S	S	*	*			trans	62.3	162	152.4	-71.4	38	0	0	0	118.2
1093	D	37.2	Very low	31.8	Very low	109 Å²	109	135.8 Å²	135.8	58%	0.583	71%	0.714	S	S	*	*			cis	-157.4	152.8	-8.8	-119.8	-17.8	0	0	0	113.6
1094	N	33.8	Very low	32.2	Very low	114 Å²	114	135.7 Å²	135.7	61%	0.61	72%	0.715	S	S	*	*			trans	50.3	137.3	137.3	-68.5	-36.5	0	0	0	124.9
1095	N	32.9	Very low	32.4	Very low	129 Å²	129	132 Å²	132	69%	0.69	71%	0.712	S	S	*	*			trans	73.3	152.8	135.5	-67	-9	0	0	0	119.5
1096	N	33.5	Very low	32.8	Very low	105 Å²	105	132.3 Å²	132.3	56%	0.561	71%	0.713	S	S	*	*			cis	-158	167.5	-7.9	-124	-19	0	0	0	112.1
1097	H	35.8	Very low	33.2	Very low	148 Å²	148	131 Å²	131	69%	0.685	72%	0.715	S	S	*	*			trans	53.2	126.5	156.4	-58	-41.5	0	0	0	119.4
1098	S	30.8	Very low	33.4	Very low	98 Å²	98	129.9 Å²	129.9	69%	0.685	71%	0.71	S	S	*	*			cis	73.2	107.9	42.5	83.8	0	0	0	0	115.7
1099	C	31.3	Very low	33.6	Very low	128 Å²	128	132.7 Å²	132.7	87%	0.865	72%	0.717	S	S	*	*				-161.3	152	127.5	-100.1	0	0	0	0	109.5
1100	N	29.5	Very low	33.2	Very low	145 Å²	145	130.4 Å²	130.4	78%	0.775	71%	0.714	S	S	*	*			trans	-95.6	175.3	169.8	-55.2	-35.7	0	0	0	109.1
1101	D	34.9	Very low	32.9	Very low	156 Å²	156	129.8 Å²	129.8	83%	0.834	72%	0.72	S	S	*	*				179.3	166	106.9	-85.2	-18.2	0	0	0	111.3
1102	E	33.6	Very low	33	Very low	184 Å²	184	132.1 Å²	132.1	86%	0.86	73%	0.73	S	S	*	*			trans	-92	-171.6	-176.8	-55	174.3	123.9	0	0	109.6
1103	E	31.4	Very low	32.8	Very low	154 Å²	154	132.2 Å²	132.2	72%	0.72	73%	0.731	S	S	*	*			cis	-168	-173	15.8	-151.6	-164.1	172.6	0	0	110.1
1104	I	32.1	Very low	32.7	Very low	138 Å²	138	135.1 Å²	135.1	71%	0.708	75%	0.746	S	S	*	*			trans	81.2	140.6	151.5	-70.3	153.4	0	0	0	120.7
1105	S	31.6	Very low	32.7	Very low	99 Å²	99	135 Å²	135	69%	0.692	75%	0.746	S	S	*	*			trans	79.6	135.4	154.7	165.4	0	0	0	0	120
1106	T	34.7	Very low	32.7	Very low	119 Å²	119	136.5 Å²	136.5	73%	0.73	75%	0.753	S	S	*	*			cis	-164	149.9	-10.7	32	0	0	0	0	112.7
1107	V	34	Very low	32.7	Very low	122 Å²	122	137.3 Å²	137.3	74%	0.739	76%	0.756	S	S	*	*			trans	62.8	132.2	142.5	176.1	0	0	0	0	121.8
1108	P	37.5	Very low	32.6	Very low	117 Å²	117	137.1 Å²	137.1	76%	0.76	76%	0.759	S	S	*	*			trans	-106.1	162.4	169.7	39.9	-33.7	0	0	0	114.9
1109	K	33.1	Very low	32.8	Very low	191 Å²	191	138.8 Å²	138.8	83%	0.83	76%	0.76	S	S	*	*			trans	-168.7	123.9	160.2	-110.8	159.4	-174.6	175.9	0	117
1110	T	29	Very low	33	Very low	116 Å²	116	136.1 Å²	136.1	71%	0.712	75%	0.754	S	S	*	*			trans	32.6	124.1	133.8	60.3	0	0	0	0	124.2
1111	S	28.8	Very low	33.3	Very low	108 Å²	108	136 Å²	136	76%	0.755	75%	0.749	S	S	*	*				52.3	134.9	120.8	-43.3	0	0	0	0	123.5
1112	I	33.5	Very low	33.3	Very low	169 Å²	169	135.7 Å²	135.7	87%	0.867	74%	0.742	S	S	*	*				179.1	155.7	118.1	-92.4	158.5	0	0	0	112.4
1113	N	29.9	Very low	33.3	Very low	127 Å²	127	133.4 Å²	133.4	68%	0.679	73%	0.734	S	S	*	*			trans	-78.2	172.3	-173	-55.5	-22.2	0	0	0	115.2
1114	N	35.3	Very low	33.5	Very low	170 Å²	170	132.7 Å²	132.7	91%	0.909	74%	0.736	S	S	*	*			trans	-150.5	153.4	131	-102.1	-38	0	0	0	112
1115	N	33.3	Very low	33.6	Very low	112 Å²	112	133.5 Å²	133.5	60%	0.599	74%	0.741	S	S	*	*			trans	-114.1	167.7	-163.5	-61.1	-35.4	0	0	0	114	I1117	N1115-I1117 HydrophobicContact CB-CD1 4.07Å; N1115-I1117 HydrophobicContact CB-CG1 4.44Å
1116	L	33.7	Very low	33.8	Very low	161 Å²	161	135.4 Å²	135.4	84%	0.843	74%	0.744	S	S	*	*			trans	166	99.5	139.5	-87.8	154.1	0	0	0	107.7
1117	I	33.4	Very low	33.7	Very low	122 Å²	122	138.1 Å²	138.1	63%	0.626	75%	0.748	S	S	*	*				67.3	118.6	65.4	-48.5	161.9	0	0	0	109.8	N1115	N1115-I1117 HydrophobicContact CB-CD1 4.07Å; N1115-I1117 HydrophobicContact CB-CG1 4.44Å
1118	L	34.1	Very low	33.6	Very low	143 Å²	143	136.1 Å²	136.1	75%	0.749	74%	0.74	S	S	*	*				-152.4	149.3	62.7	-76.5	161.3	0	0	0	114.8
1119	N	34.6	Very low	33.4	Very low	134 Å²	134	138 Å²	138	72%	0.717	74%	0.744	S	S	*	*			trans	32.5	134.6	140.6	-46.5	3	0	0	0	120.6
1120	G	34.7	Very low	33.1	Very low	71 Å²	71	133.2 Å²	133.2	73%	0.732	73%	0.734	S	S	*	*			cis	-171.8	-150.5	1.9	0	0	0	0	0	108.8
1121	H	37	Very low	32.9	Very low	144 Å²	144	132.4 Å²	132.4	67%	0.667	73%	0.732	S	S	*	*			cis	-159	165.4	-0.6	-93.8	-86.5	0	0	0	109.3
1122	E	33.5	Very low	32.6	Very low	149 Å²	149	132.6 Å²	132.6	70%	0.696	72%	0.724	S	S	*	*			trans	10.5	149	140.5	-68.2	147.8	-118.3	0	0	120.7
1123	I	34.4	Very low	32.3	Very low	135 Å²	135	131.9 Å²	131.9	69%	0.692	72%	0.72	S	S	*	*			cis	-165.6	158.4	11.3	-113.5	157.5	0	0	0	106.4
1124	D	35.2	Very low	32.5	Very low	140 Å²	140	132.2 Å²	132.2	75%	0.749	72%	0.722	S	S	*	*			cis	-170.3	168.6	-25.3	-87.4	-0.3	0	0	0	105.4
1125	D	34.1	Very low	32.3	Very low	154 Å²	154	130.2 Å²	130.2	82%	0.824	71%	0.712	S	S	*	*			cis	-157.2	-114.4	-45.8	-165.7	20.9	0	0	0	108.6
1126	D	35.3	Very low	32.2	Very low	140 Å²	140	131.2 Å²	131.2	75%	0.749	72%	0.719	S	S	*	*			trans	53.4	99.9	169.2	-74.6	-12.7	0	0	0	120.8
1127	E	34.1	Very low	32.2	Very low	176 Å²	176	129.4 Å²	129.4	82%	0.822	71%	0.711	S	S	*	*				62	149.1	115.5	-76.4	-145.4	-163.1	0	0	123.2
1128	S	32.2	Very low	32.1	Very low	80 Å²	80	129.9 Å²	129.9	56%	0.559	72%	0.717	S	S	*	*			cis	-165.7	153.6	-18.5	45.9	0	0	0	0	110.2
1129	D	31.6	Very low	32	Very low	157 Å²	157	129 Å²	129	84%	0.84	72%	0.715	S	S	*	*			trans	52.8	161.9	155.4	-71.9	-3.9	0	0	0	122.8
1130	S	27.3	Very low	31.8	Very low	89 Å²	89	128.6 Å²	128.6	62%	0.622	72%	0.715	S	S	*	*			cis	-164	169.2	-32.3	62.1	0	0	0	0	111.4
1131	C	25.8	Very low	31.5	Very low	100 Å²	100	133.1 Å²	133.1	68%	0.676	71%	0.713	S	S	*	*			trans	42	113.2	152	-62.8	0	0	0	0	125.2
1132	L	22.4	Very low	31.1	Very low	111 Å²	111	132.2 Å²	132.2	58%	0.581	72%	0.717	S	S	*	*				35.7	119.8	120	-70.8	165.4	0	0	0	123.6	L773 P774	L773-L1132 CarbonylContact O-C 3.53Å; L773-L1132 VanDerWaalsContact O-C 3.28Å; P774-L1132 WeakPolarHBondContact O-CD2 3.39Å
1133	I	27.1	Very low	30.9	Very low	155 Å²	155	130.6 Å²	130.6	80%	0.795	72%	0.719	S	S	*	*			trans	-156.7	0	153.4	-54.3	-172.4	0	0	0	110	L773 P774 D775	L773-I1133 VanDerWaalsContact C-N 3.25Å; L773-I1133 CarbonylContact C-O 3.28Å; L773-I1133 VanDerWaalsContact C-O 3.27Å; L773-I1133 PolarHBondContact O-N 2.81Å; P774-I1133 CarbonylContact C-O 3.28Å; P774-I1133 WeakPolarHBondContact CA-O 3.44Å; P774-I1133 CarbonylContact O-C 3.57Å; P774-I1133 VanDerWaalsContact O-C 3.28Å; P774-I1133 PolarHBondContact O-N 2.72Å; D775-I1133 PolarHBondContact N-O 3.5Å

Retrieved 1,133 of 1,133 residues in 1838.4 ms (Link to these results)

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