G4VC92_SCHMA Loading...

Transcription intermediary factor 1-related

AlphaFold DB , UniProt , Accession G4VC92, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 705 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	36.5	Very low	43.1	Very low	169 Å²	169	106.8 Å²	106.8	83%	0.833	59%	0.586	S	S	*	*				0	116.9	0	-63.2	-168.6	-154.9	0	0	106.9	F7	M1-F7 WeakPolarHBondContact O-CE2 3.39Å; M1-F7 WeakPolarHBondContact O-CZ 3.21Å
2	D	38.2	Very low	43.1	Very low	120 Å²	120	113 Å²	113	64%	0.642	61%	0.608	S	S	*	*			trans	-86	116.3	178.3	-150.2	-4.3	0	0	0	107.4	G4	D2-G4 PolarHBondContact O-N 3.13Å
3	C	43.5	Very low	43.3	Very low	34 Å²	34	110.2 Å²	110.2	23%	0.23	59%	0.588	C	S	.	*			trans	-80.5	31.4	-175.5	53.9	0	0	0	0	112.9	N5 C24 T43	C3-N5 PolarHBondContact O-N 2.96Å; C3-C24 HydrophobicContact CB-CB 4.44Å; C3-C24 WeakPolarHBondContact SG-CB 3.5Å; C3-T43 WeakPolarHBondContact CB-OG1 3.47Å
4	G	46.4	Very low	43.6	Very low	70 Å²	70	107.4 Å²	107.4	72%	0.722	58%	0.582	S	S	*	*	S	Bend	trans	77.1	-22.7	176.5	0	0	0	0	0	116	D2	D2-G4 PolarHBondContact O-N 3.13Å
5	N	46	Very low	44.2	Very low	111 Å²	111	108.3 Å²	108.3	59%	0.594	60%	0.595	S	S	*	*	S	Bend	trans	-104.5	4.3	-179	-82	-10.1	0	0	0	115.4	C3 C24	C3-N5 PolarHBondContact O-N 2.96Å; N5-C24 PolarHBondContact ND2-O 3.15Å
6	G	44	Very low	44.8	Very low	29 Å²	29	112.9 Å²	112.9	30%	0.299	61%	0.611	S	S	.	*			trans	70	138.7	-176.5	0	0	0	0	0	112.4	K8	G6-K8 PolarHBondContact O-N 2.53Å
7	F	40.8	Very low	45.8	Very low	110 Å²	110	109.9 Å²	109.9	48%	0.482	60%	0.595	S	S	.	*			trans	-69.7	75.6	173.4	-75	-90.2	0	0	0	111	M1	M1-F7 WeakPolarHBondContact O-CE2 3.39Å; M1-F7 WeakPolarHBondContact O-CZ 3.21Å
8	K	45.7	Very low	47	Very low	167 Å²	167	108.4 Å²	108.4	73%	0.726	59%	0.592	S	S	*	*			trans	-99.2	111.9	158.8	-76.8	-174.8	177.8	-179.7	0	107.2	G6 N10	G6-K8 PolarHBondContact O-N 2.53Å; K8-N10 PolarHBondContact O-N 3.35Å
9	L	43.1	Very low	48.3	Very low	120 Å²	120	105.9 Å²	105.9	63%	0.628	58%	0.577	S	S	*	*			trans	-57.5	93.1	163.2	-84.6	147.7	0	0	0	107.7	L11	L9-L11 VanDerWaalsContact C-N 3.33Å; L9-L11 PolarHBondContact O-N 3.39Å
10	N	43.8	Very low	49.6	Very low	92 Å²	92	101.9 Å²	101.9	49%	0.492	56%	0.556	S	S	.	*			trans	-74.2	94.1	167	-90.3	-22.3	0	0	0	107.2	K8 E12	K8-N10 PolarHBondContact O-N 3.35Å; N10-E12 PolarHBondContact O-N 3.48Å
11	L	46.7	Very low	50.9	Low	153 Å²	153	97.1 Å²	97.1	80%	0.801	53%	0.53	S	S	*	.			trans	-67.9	-13.3	170.7	-75.4	154.5	0	0	0	112	L9 H13	L9-L11 VanDerWaalsContact C-N 3.33Å; L9-L11 PolarHBondContact O-N 3.39Å; L11-H13 PolarHBondContact O-N 3.4Å
12	E	43	Very low	52.8	Low	181 Å²	181	89.7 Å²	89.7	85%	0.846	50%	0.495	S	S	*	.			trans	-87.5	70.9	173.5	-64.8	179.9	-177.7	0	0	110	N10 S14	N10-E12 PolarHBondContact O-N 3.48Å; E12-S14 PolarHBondContact O-N 3.06Å
13	H	45.5	Very low	54.6	Low	77 Å²	77	84.8 Å²	84.8	36%	0.356	47%	0.469	S	S	.	.			trans	-68.8	104.8	169.7	-158.6	-29	0	0	0	108.3	L11 P15	L11-H13 PolarHBondContact O-N 3.4Å; H13-P15 WeakPolarHBondContact O-CD 3.36Å
14	S	47.2	Very low	56.2	Low	71 Å²	71	83.6 Å²	83.6	50%	0.497	46%	0.462	S	S	.	.			trans	-66.3	124.4	168.2	58.9	0	0	0	0	108.4	E12 E16	E12-S14 PolarHBondContact O-N 3.06Å; S14-E16 PolarHBondContact O-N 3.49Å; S14-E16 VanDerWaalsContact O-N 3.11Å
15	P	53.1	Low	57.5	Low	121 Å²	121	83 Å²	83	79%	0.786	45%	0.446	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.6	-3.2	176.7	26.6	-33.3	0	0	0	113.5	H13 N17	H13-P15 WeakPolarHBondContact O-CD 3.36Å; P15-N17 VanDerWaalsContact C-N 3.31Å; P15-N17 PolarHBondContact O-N 3.28Å
16	E	53.8	Low	58.6	Low	182 Å²	182	78.5 Å²	78.5	85%	0.85	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69	-23.3	-173.6	-63.3	-173	169.7	0	0	114	S14	S14-E16 PolarHBondContact O-N 3.49Å; S14-E16 VanDerWaalsContact O-N 3.11Å
17	N	61.7	Low	59.6	Low	61 Å²	61	85.1 Å²	85.1	33%	0.326	44%	0.442	S	S	.	.			trans	-143.6	94	174.8	-163.1	-6.1	0	0	0	112	P15 L19	P15-N17 VanDerWaalsContact C-N 3.31Å; P15-N17 PolarHBondContact O-N 3.28Å; N17-L19 PolarHBondContact O-N 3.24Å; N17-L19 PolarHBondContact OD1-N 3.17Å
18	P	66.9	Low	60.5	Low	84 Å²	84	86.8 Å²	86.8	55%	0.545	45%	0.451	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.2	-4.3	-178.5	30.6	-35.1	0	0	0	113.5
19	L	71.4	Confident	61.1	Low	60 Å²	60	78.9 Å²	78.9	31%	0.314	42%	0.417	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.1	27.1	-173.7	-55.4	-173.4	0	0	0	113.4	N17 V29 I72	N17-L19 PolarHBondContact O-N 3.24Å; N17-L19 PolarHBondContact OD1-N 3.17Å; L19-V29 WeakPolarHBondContact O-CG2 3.34Å; L19-I72 HydrophobicContact CD1-CG2 4.32Å; L19-I72 HydrophobicContact CD2-CG2 3.49Å; L19-I72 VanDerWaalsContact CD2-CG2 3.49Å; L19-I72 HydrophobicContact CG-CG2 4.43Å
20	V	74.5	Confident	62.2	Low	26 Å²	26	77.3 Å²	77.3	16%	0.158	41%	0.405	C	S	.	.	S	Bend	trans	-112.7	158.2	170	-62.4	0	0	0	0	110	S22 R27	V20-S22 PolarHBondContact O-N 3.11Å; V20-S22 VanDerWaalsContact O-N 3.17Å; V20-R27 HydrophobicContact CG1-CG 4.46Å
21	C	78.2	Confident	63.7	Low	1 Å²	1	73.1 Å²	73.1	1%	0.007	38%	0.383	C	S	.	.			trans	-60.4	124	175.3	177.9	0	0	0	0	110.7	V23 C24 S25 G26 V39 C41	C21-V23 PolarHBondContact O-N 3.48Å; C21-C24 VanDerWaalsContact CB-SG 3.6Å; C21-S25 VanDerWaalsContact O-CA 3.22Å; C21-S25 WeakPolarHBondContact O-CA 3.48Å; C21-S25 PolarHBondContact O-N 2.96Å; C21-G26 WeakPolarHBondContact CB-O 3.2Å; C21-G26 PolarHBondContact N-O 3.1Å; C21-V39 WeakPolarHBondContact CA-O 3.29Å; C21-C41 HydrophobicContact CB-CB 4.12Å; C21-C41 PolarHBondContact SG-N 3.4Å; C21-C41 VanDerWaalsContact SG-N 3.38Å
22	S	75.8	Confident	65.6	Low	14 Å²	14	67 Å²	67	10%	0.098	35%	0.351	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.2	-11.8	-178.9	-61.6	0	0	0	0	114.3	V20 V39	V20-S22 PolarHBondContact O-N 3.11Å; V20-S22 VanDerWaalsContact O-N 3.17Å; S22-V39 WeakPolarHBondContact CB-O 3.42Å; S22-V39 PolarHBondContact N-O 3.4Å; S22-V39 PolarHBondContact OG-N 3.35Å; S22-V39 PolarHBondContact OG-O 2.89Å
23	V	76.6	Confident	67.6	Low	16 Å²	16	58.5 Å²	58.5	10%	0.097	31%	0.311	C	S	.	.	T	Hydrogen-bonded Turn	trans	-110.9	-47.5	-175.8	-177.9	0	0	0	0	112.5	C21 C44 M48 V57	C21-V23 PolarHBondContact O-N 3.48Å; V23-C44 HydrophobicContact CB-CB 4.12Å; V23-C44 HydrophobicContact CG2-CB 4.3Å; V23-M48 HydrophobicContact CB-CE 4.42Å; V23-M48 HydrophobicContact CG2-CE 3.08Å; V23-V57 HydrophobicContact CG2-CG2 3.57Å
24	C	76.8	Confident	69.6	Low	10 Å²	10	57.3 Å²	57.3	7%	0.068	31%	0.311	C	S	.	.	T	Hydrogen-bonded Turn	trans	-110.7	-0.4	-174.7	69.2	0	0	0	0	114.6	C3 N5 C21 G26 C41	C3-C24 HydrophobicContact CB-CB 4.44Å; C3-C24 WeakPolarHBondContact SG-CB 3.5Å; N5-C24 PolarHBondContact ND2-O 3.15Å; C21-C24 VanDerWaalsContact CB-SG 3.6Å; C24-G26 PolarHBondContact O-N 3.4Å; C24-G26 PolarHBondContact SG-N 3.45Å; C24-G26 VanDerWaalsContact SG-N 3.38Å; C24-C41 VanDerWaalsContact SG-SG 3.68Å
25	S	73.9	Confident	71.5	Confident	58 Å²	58	56.3 Å²	56.3	41%	0.406	31%	0.307	S	S	.	.			trans	55.3	16.9	-173	-50.5	0	0	0	0	114	C21	C21-S25 VanDerWaalsContact O-CA 3.22Å; C21-S25 WeakPolarHBondContact O-CA 3.48Å; C21-S25 PolarHBondContact O-N 2.96Å
26	G	67.7	Low	73.2	Confident	16 Å²	16	51.8 Å²	51.8	17%	0.165	28%	0.278	C	S	.	.			trans	-68.2	141.4	175.2	0	0	0	0	0	111.4	C21 C24 E28	C21-G26 WeakPolarHBondContact CB-O 3.2Å; C21-G26 PolarHBondContact N-O 3.1Å; C24-G26 PolarHBondContact O-N 3.4Å; C24-G26 PolarHBondContact SG-N 3.45Å; C24-G26 VanDerWaalsContact SG-N 3.38Å; G26-E28 VanDerWaalsContact C-N 3.32Å
27	R	64.5	Low	74.8	Confident	168 Å²	168	49.1 Å²	49.1	63%	0.634	27%	0.269	S	S	*	.	S	Bend	trans	-81.9	-10.1	178.1	-62.5	-177	-155.9	-112.5	-8.9	113.4	V20 V29 E76	V20-R27 HydrophobicContact CG1-CG 4.46Å; R27-V29 PolarHBondContact O-N 3.27Å; R27-E76 IonicContact CZ-OE2 3.8Å; R27-E76 IonicContact NH1-OE2 3.14Å; R27-E76 PolarHBondContact NH1-OE2 3.24Å
28	E	59.7	Low	75.9	Confident	145 Å²	145	48.7 Å²	48.7	68%	0.678	27%	0.265	S	S	*	.			trans	-78.2	71.4	173.6	-69.7	-172.8	179.9	0	0	110.1	G26 F30 C41	G26-E28 VanDerWaalsContact C-N 3.32Å; E28-F30 HydrophobicContact CB-CE2 4.03Å; E28-F30 WeakPolarHBondContact O-CD2 3.4Å; E28-C41 WeakPolarHBondContact O-CA 3.42Å; E28-C41 WeakPolarHBondContact O-CB 3.32Å
29	V	58.8	Low	76.7	Confident	1 Å²	1	45.1 Å²	45.1	1%	0.006	24%	0.241	C	C	.	.			trans	-80.1	139.8	178.8	163.1	0	0	0	0	109.2	L19 R27 V39 C73	L19-V29 WeakPolarHBondContact O-CG2 3.34Å; R27-V29 PolarHBondContact O-N 3.27Å; V29-V39 HydrophobicContact CB-CG1 3.9Å; V29-V39 HydrophobicContact CG1-CG1 3.02Å; V29-V39 HydrophobicContact CG2-CG1 3.59Å; V29-C73 HydrophobicContact CG1-CB 4.4Å; V29-C73 WeakPolarHBondContact O-CA 3.32Å; V29-C73 WeakPolarHBondContact O-CB 3.41Å; V29-C73 PolarHBondContact O-SG 3.43Å
30	F	66.2	Low	77.3	Confident	87 Å²	87	42.3 Å²	42.3	38%	0.382	23%	0.226	S	C	.	.			trans	-135.6	-28.5	173.7	-71.3	-84	0	0	0	113.8	E28 A40 V42 S68 C73	E28-F30 HydrophobicContact CB-CE2 4.03Å; E28-F30 WeakPolarHBondContact O-CD2 3.4Å; F30-A40 PolarHBondContact N-O 3.08Å; F30-V42 HydrophobicContact CB-CG2 3.63Å; F30-V42 HydrophobicContact CD1-CG2 4.42Å; F30-V42 HydrophobicContact CD2-CG2 3.49Å; F30-V42 VanDerWaalsContact CD2-CG2 3.49Å; F30-V42 HydrophobicContact CE2-CG2 4.2Å; F30-V42 HydrophobicContact CG-CG2 3.59Å; F30-S68 VanDerWaalsContact O-CA 3.29Å; F30-S68 WeakPolarHBondContact O-CA 3.47Å; F30-S68 PolarHBondContact O-OG 3.18Å; F30-C73 WeakPolarHBondContact CA-SG 3.35Å
31	G	76.8	Confident	77.5	Confident	3 Å²	3	41.4 Å²	41.4	3%	0.031	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	129.9	-169.3	0	0	0	0	0	114.5	V39 A40	G31-V39 WeakPolarHBondContact O-CA 3.39Å; G31-A40 PolarHBondContact N-O 3.01Å; G31-A40 PolarHBondContact O-N 3.29Å
32	I	84.8	Confident	77.5	Confident	25 Å²	25	44.8 Å²	44.8	13%	0.128	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	130.3	169.6	-54.9	166.3	0	0	0	108.3	P34 L37 V39 I67 N69 I72	I32-P34 VanDerWaalsContact O-CD 3.3Å; I32-P34 WeakPolarHBondContact O-CD 3.28Å; I32-L37 HydrophobicContact CG2-CD2 4.46Å; I32-V39 HydrophobicContact CG1-CG2 4.46Å; I32-I67 HydrophobicContact CB-CB 4.27Å; I32-I67 PolarHBondContact N-O 3.49Å; I32-I67 PolarHBondContact O-N 3.44Å; I32-N69 HydrophobicContact CD1-CB 4.45Å; I32-I72 HydrophobicContact CD1-CD1 3.88Å
33	L	86.7	Confident	77.7	Confident	2 Å²	2	46.5 Å²	46.5	1%	0.01	25%	0.252	C	S	.	.			trans	-82.4	109.7	170.7	-65.9	169.6	0	0	0	108.9	A35 C36 L37 H38 M48 Y54 C56 I66	L33-A35 VanDerWaalsContact C-N 3.28Å; L33-A35 PolarHBondContact O-N 2.88Å; L33-C36 PolarHBondContact O-N 2.88Å; L33-L37 WeakPolarHBondContact O-CA 3.45Å; L33-L37 PolarHBondContact O-N 3.32Å; L33-H38 HydrophobicContact CD1-CB 4.4Å; L33-H38 PolarHBondContact N-O 3.48Å; L33-M48 HydrophobicContact CD1-SD 4.05Å; L33-Y54 HydrophobicContact CD2-CG 4.46Å; L33-C56 HydrophobicContact CD1-CB 3.76Å; L33-I66 HydrophobicContact CD2-CG1 4.19Å
34	P	86.1	Confident	78	Confident	53 Å²	53	45.9 Å²	45.9	34%	0.344	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.1	-26.7	-172.9	23.2	-35.7	0	0	0	114.9	I32 S63 K65 I67	I32-P34 VanDerWaalsContact O-CD 3.3Å; I32-P34 WeakPolarHBondContact O-CD 3.28Å; P34-S63 WeakPolarHBondContact CD-OG 3.42Å; P34-K65 WeakPolarHBondContact CD-O 3.34Å; P34-K65 VanDerWaalsContact CG-O 3.26Å; P34-K65 WeakPolarHBondContact CG-O 3.32Å; P34-I67 HydrophobicContact CB-CD1 4Å
35	A	88.6	Confident	78.3	Confident	50 Å²	50	45.8 Å²	45.8	41%	0.413	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.1	-47.3	-179.8	0	0	0	0	0	111.7	L33 E61 S63	L33-A35 VanDerWaalsContact C-N 3.28Å; L33-A35 PolarHBondContact O-N 2.88Å; A35-E61 HydrophobicContact CB-CB 4.07Å; A35-E61 WeakPolarHBondContact CB-OE2 3.36Å; A35-S63 WeakPolarHBondContact CB-OG 3.35Å; A35-S63 PolarHBondContact N-OG 3.11Å
36	C	88.7	Confident	78.7	Confident	26 Å²	26	48.1 Å²	48.1	18%	0.176	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-113.2	-5.1	-172.9	59	0	0	0	0	114.8	L33 H38 C59 E61	L33-C36 PolarHBondContact O-N 2.88Å; C36-H38 PolarHBondContact O-N 3.36Å; C36-H38 PolarHBondContact SG-ND1 3.11Å; C36-H38 VanDerWaalsContact SG-ND1 3.42Å; C36-C59 WeakPolarHBondContact CB-SG 3.38Å; C36-C59 VanDerWaalsContact SG-SG 3.65Å; C36-E61 WeakPolarHBondContact CA-OE2 3.44Å; C36-E61 HydrophobicContact CB-CB 4.16Å; C36-E61 HydrophobicContact CB-CG 4.43Å; C36-E61 WeakPolarHBondContact CB-OE2 3.42Å; C36-E61 PolarHBondContact N-OE2 2.9Å
37	L	87	Confident	79.4	Confident	125 Å²	125	55 Å²	55	65%	0.654	28%	0.275	S	S	*	.			trans	60.7	7.6	-175.9	-51.2	177.1	0	0	0	115.3	I32 L33	I32-L37 HydrophobicContact CG2-CD2 4.46Å; L33-L37 WeakPolarHBondContact O-CA 3.45Å; L33-L37 PolarHBondContact O-N 3.32Å
38	H	85.5	Confident	80.3	Confident	53 Å²	53	47.4 Å²	47.4	25%	0.245	25%	0.247	C	C	.	.			trans	-65.5	149.6	171.5	-70.5	126.4	0	0	0	111.5	L33 C36 C56	L33-H38 HydrophobicContact CD1-CB 4.4Å; L33-H38 PolarHBondContact N-O 3.48Å; C36-H38 PolarHBondContact O-N 3.36Å; C36-H38 PolarHBondContact SG-ND1 3.11Å; C36-H38 VanDerWaalsContact SG-ND1 3.42Å; H38-C56 PolarHBondContact ND1-SG 3.32Å; H38-C56 VanDerWaalsContact ND1-SG 3.4Å
39	V	83.5	Confident	81.4	Confident	8 Å²	8	46.7 Å²	46.7	5%	0.048	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	132.6	-169.1	177.8	0	0	0	0	110.4	C21 S22 V29 G31 I32	C21-V39 WeakPolarHBondContact CA-O 3.29Å; S22-V39 WeakPolarHBondContact CB-O 3.42Å; S22-V39 PolarHBondContact N-O 3.4Å; S22-V39 PolarHBondContact OG-N 3.35Å; S22-V39 PolarHBondContact OG-O 2.89Å; V29-V39 HydrophobicContact CB-CG1 3.9Å; V29-V39 HydrophobicContact CG1-CG1 3.02Å; V29-V39 HydrophobicContact CG2-CG1 3.59Å; G31-V39 WeakPolarHBondContact O-CA 3.39Å; I32-V39 HydrophobicContact CG1-CG2 4.46Å
40	A	83.4	Confident	82.4	Confident	1 Å²	1	53.6 Å²	53.6	1%	0.008	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	146.3	179.1	0	0	0	0	0	112.4	F30 G31 C44 A45 M48	F30-A40 PolarHBondContact N-O 3.08Å; G31-A40 PolarHBondContact N-O 3.01Å; G31-A40 PolarHBondContact O-N 3.29Å; A40-C44 HydrophobicContact CB-CB 4.45Å; A40-A45 HydrophobicContact CB-CB 4.23Å; A40-M48 HydrophobicContact CB-CE 4.1Å; A40-M48 HydrophobicContact CB-SD 4.46Å
41	C	79.4	Confident	83.1	Confident	8 Å²	8	56.2 Å²	56.2	5%	0.054	29%	0.286	C	S	.	.			trans	-74.9	163.8	166.5	68	0	0	0	0	110.3	C21 C24 E28 T43 C44 A45	C21-C41 HydrophobicContact CB-CB 4.12Å; C21-C41 PolarHBondContact SG-N 3.4Å; C21-C41 VanDerWaalsContact SG-N 3.38Å; C24-C41 VanDerWaalsContact SG-SG 3.68Å; E28-C41 WeakPolarHBondContact O-CA 3.42Å; E28-C41 WeakPolarHBondContact O-CB 3.32Å; C41-T43 VanDerWaalsContact C-N 3.28Å; C41-T43 PolarHBondContact O-N 3.01Å; C41-T43 PolarHBondContact SG-OG1 3.43Å; C41-C44 PolarHBondContact O-N 2.89Å; C41-C44 VanDerWaalsContact SG-CB 3.6Å; C41-C44 PolarHBondContact SG-N 3.43Å; C41-C44 PolarHBondContact SG-SG 2.92Å; C41-A45 VanDerWaalsContact O-CB 3.29Å; C41-A45 WeakPolarHBondContact O-CB 3.4Å; C41-A45 PolarHBondContact O-N 3.35Å
42	V	78.2	Confident	83.4	Confident	71 Å²	71	61.5 Å²	61.5	43%	0.43	31%	0.313	S	S	.	.	H	α-helix	trans	-53.6	-45.6	-178.2	179.1	0	0	0	0	111.8	F30 C44 A45 E46	F30-V42 HydrophobicContact CB-CG2 3.63Å; F30-V42 HydrophobicContact CD1-CG2 4.42Å; F30-V42 HydrophobicContact CD2-CG2 3.49Å; F30-V42 VanDerWaalsContact CD2-CG2 3.49Å; F30-V42 HydrophobicContact CE2-CG2 4.2Å; F30-V42 HydrophobicContact CG-CG2 3.59Å; V42-C44 PolarHBondContact O-N 3.44Å; V42-A45 PolarHBondContact O-N 3.29Å; V42-E46 WeakPolarHBondContact O-CG 3.37Å; V42-E46 PolarHBondContact O-N 2.89Å
43	T	79.5	Confident	83.5	Confident	51 Å²	51	62.6 Å²	62.6	31%	0.313	32%	0.321	S	S	.	.	H	α-helix	trans	-66.4	-39.2	-177.7	56.8	0	0	0	0	112.6	C3 C41 Y47	C3-T43 WeakPolarHBondContact CB-OG1 3.47Å; C41-T43 VanDerWaalsContact C-N 3.28Å; C41-T43 PolarHBondContact O-N 3.01Å; C41-T43 PolarHBondContact SG-OG1 3.43Å; T43-Y47 PolarHBondContact O-N 2.94Å
44	C	83.3	Confident	83.5	Confident	2 Å²	2	64.4 Å²	64.4	1%	0.014	33%	0.328	C	S	.	.	H	α-helix	trans	-75.4	-34.1	176.4	-68.2	0	0	0	0	112.1	V23 A40 C41 V42 Y47 M48	V23-C44 HydrophobicContact CB-CB 4.12Å; V23-C44 HydrophobicContact CG2-CB 4.3Å; A40-C44 HydrophobicContact CB-CB 4.45Å; C41-C44 PolarHBondContact O-N 2.89Å; C41-C44 VanDerWaalsContact SG-CB 3.6Å; C41-C44 PolarHBondContact SG-N 3.43Å; C41-C44 PolarHBondContact SG-SG 2.92Å; V42-C44 PolarHBondContact O-N 3.44Å; C44-Y47 WeakPolarHBondContact O-CB 3.25Å; C44-Y47 PolarHBondContact O-N 3Å; C44-M48 VanDerWaalsContact O-CG 3.31Å; C44-M48 WeakPolarHBondContact O-CG 3.22Å; C44-M48 PolarHBondContact O-N 2.96Å
45	A	82.7	Confident	83.5	Confident	9 Å²	9	63.7 Å²	63.7	7%	0.074	32%	0.324	C	S	.	.	H	α-helix	trans	-63.6	-42	174.7	0	0	0	0	0	111.9	A40 C41 V42 Y47 M48 R49 Y54 I66	A40-A45 HydrophobicContact CB-CB 4.23Å; C41-A45 VanDerWaalsContact O-CB 3.29Å; C41-A45 WeakPolarHBondContact O-CB 3.4Å; C41-A45 PolarHBondContact O-N 3.35Å; V42-A45 PolarHBondContact O-N 3.29Å; A45-Y47 VanDerWaalsContact C-N 3.33Å; A45-M48 PolarHBondContact O-N 3.28Å; A45-R49 PolarHBondContact O-N 2.95Å; A45-Y54 WeakPolarHBondContact O-CD1 3.23Å; A45-I66 HydrophobicContact CB-CD1 3.57Å
46	E	81.9	Confident	83.4	Confident	106 Å²	106	61.4 Å²	61.4	50%	0.495	31%	0.305	S	S	.	.	H	α-helix	trans	-61.6	-41.1	172.3	-75.8	177.6	-178.1	0	0	111.9	V42 M48 R49	V42-E46 WeakPolarHBondContact O-CG 3.37Å; V42-E46 PolarHBondContact O-N 2.89Å; E46-M48 VanDerWaalsContact C-N 3.32Å; E46-M48 PolarHBondContact O-N 2.88Å; E46-R49 WeakPolarHBondContact O-CB 3.41Å; E46-R49 PolarHBondContact O-N 3.42Å
47	Y	82.1	Confident	83.3	Confident	160 Å²	160	62.7 Å²	62.7	63%	0.627	31%	0.312	S	S	*	.	H	α-helix	trans	-64.5	-34.4	176.3	-179.8	-98.2	0	0	0	113.2	T43 C44 A45 R49	T43-Y47 PolarHBondContact O-N 2.94Å; C44-Y47 WeakPolarHBondContact O-CB 3.25Å; C44-Y47 PolarHBondContact O-N 3Å; A45-Y47 VanDerWaalsContact C-N 3.33Å; Y47-R49 VanDerWaalsContact C-N 3.26Å; Y47-R49 PolarHBondContact O-N 3.25Å
48	M	84	Confident	83.1	Confident	10 Å²	10	59.5 Å²	59.5	5%	0.049	30%	0.295	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.9	-11.5	176.6	-72.7	-179.1	-158.1	0	0	114.1	V23 L33 A40 C44 A45 E46 K50 C55 V57	V23-M48 HydrophobicContact CB-CE 4.42Å; V23-M48 HydrophobicContact CG2-CE 3.08Å; L33-M48 HydrophobicContact CD1-SD 4.05Å; A40-M48 HydrophobicContact CB-CE 4.1Å; A40-M48 HydrophobicContact CB-SD 4.46Å; C44-M48 VanDerWaalsContact O-CG 3.31Å; C44-M48 WeakPolarHBondContact O-CG 3.22Å; C44-M48 PolarHBondContact O-N 2.96Å; A45-M48 PolarHBondContact O-N 3.28Å; E46-M48 VanDerWaalsContact C-N 3.32Å; E46-M48 PolarHBondContact O-N 2.88Å; M48-K50 PolarHBondContact O-N 3.39Å; M48-C55 WeakPolarHBondContact CB-O 3.33Å; M48-C55 WeakPolarHBondContact CG-O 3.42Å; M48-C55 PolarHBondContact O-N 2.67Å; M48-V57 HydrophobicContact CE-CG2 4.07Å; M48-V57 HydrophobicContact CG-CG1 4.14Å
49	R	83.4	Confident	83.1	Confident	130 Å²	130	59.3 Å²	59.3	49%	0.491	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	120	-177	-170.7	177.9	177.5	166.1	-2.4	110.2	A45 E46 Y47 D52 V53 Y54	A45-R49 PolarHBondContact O-N 2.95Å; E46-R49 WeakPolarHBondContact O-CB 3.41Å; E46-R49 PolarHBondContact O-N 3.42Å; Y47-R49 VanDerWaalsContact C-N 3.26Å; Y47-R49 PolarHBondContact O-N 3.25Å; R49-D52 IonicContact CZ-OD1 3.11Å; R49-D52 IonicContact NE-OD1 3.4Å; R49-D52 PolarHBondContact NE-OD1 3.13Å; R49-D52 IonicContact NH2-OD1 2.78Å; R49-D52 PolarHBondContact NH2-OD1 3.24Å; R49-V53 WeakPolarHBondContact CA-O 3.29Å; R49-Y54 HydrophobicContact CB-CD1 3.93Å; R49-Y54 HydrophobicContact CB-CE1 3.79Å; R49-Y54 HydrophobicContact CG-CD1 4.33Å; R49-Y54 HydrophobicContact CG-CE1 3.97Å
50	K	79.1	Confident	83.2	Confident	145 Å²	145	64.6 Å²	64.6	63%	0.63	33%	0.327	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-134.6	125.4	173.9	-172.9	179.4	177.7	-176.2	0	108.6	M48 D52 V53	M48-K50 PolarHBondContact O-N 3.39Å; K50-D52 VanDerWaalsContact C-N 3.3Å; K50-D52 PolarHBondContact O-N 3.04Å; K50-V53 PolarHBondContact N-O 3.46Å; K50-V53 WeakPolarHBondContact O-CG2 3.45Å; K50-V53 PolarHBondContact O-N 3.45Å
51	D	80.6	Confident	83.5	Confident	143 Å²	143	68.7 Å²	68.7	77%	0.765	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.9	46.2	177	-52.4	-38.8	0	0	0	113.8	V53	D51-V53 PolarHBondContact O-N 3.49Å; D51-V53 VanDerWaalsContact O-N 3.15Å
52	D	82.4	Confident	83.9	Confident	113 Å²	113	73.6 Å²	73.6	60%	0.604	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.3	11.1	-177.4	-75.2	-25.7	0	0	0	117.2	R49 K50	R49-D52 IonicContact CZ-OD1 3.11Å; R49-D52 IonicContact NE-OD1 3.4Å; R49-D52 PolarHBondContact NE-OD1 3.13Å; R49-D52 IonicContact NH2-OD1 2.78Å; R49-D52 PolarHBondContact NH2-OD1 3.24Å; K50-D52 VanDerWaalsContact C-N 3.3Å; K50-D52 PolarHBondContact O-N 3.04Å
53	V	87.1	Confident	84.4	Confident	48 Å²	48	70.3 Å²	70.3	29%	0.291	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	150.4	167.8	-71.8	0	0	0	0	111.2	R49 K50 D51 L62	R49-V53 WeakPolarHBondContact CA-O 3.29Å; K50-V53 PolarHBondContact N-O 3.46Å; K50-V53 WeakPolarHBondContact O-CG2 3.45Å; K50-V53 PolarHBondContact O-N 3.45Å; D51-V53 PolarHBondContact O-N 3.49Å; D51-V53 VanDerWaalsContact O-N 3.15Å; V53-L62 HydrophobicContact CG2-CD2 4.13Å
54	Y	86.9	Confident	84.7	Confident	40 Å²	40	75.4 Å²	75.4	16%	0.157	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	116.9	177.5	-60.9	-86.9	0	0	0	109.4	L33 A45 R49 L62 S63 I66	L33-Y54 HydrophobicContact CD2-CG 4.46Å; A45-Y54 WeakPolarHBondContact O-CD1 3.23Å; R49-Y54 HydrophobicContact CB-CD1 3.93Å; R49-Y54 HydrophobicContact CB-CE1 3.79Å; R49-Y54 HydrophobicContact CG-CD1 4.33Å; R49-Y54 HydrophobicContact CG-CE1 3.97Å; Y54-L62 WeakPolarHBondContact O-CA 3.38Å; Y54-S63 PolarHBondContact N-O 3.1Å; Y54-S63 PolarHBondContact O-N 3.33Å; Y54-I66 HydrophobicContact CD1-CD1 3.42Å; Y54-I66 VanDerWaalsContact CD1-CD1 3.42Å; Y54-I66 HydrophobicContact CD1-CG1 4.01Å; Y54-I66 HydrophobicContact CD2-CD1 4.11Å; Y54-I66 HydrophobicContact CD2-CG1 3.77Å; Y54-I66 HydrophobicContact CE1-CD1 3.35Å; Y54-I66 HydrophobicContact CE1-CG1 4.08Å; Y54-I66 HydrophobicContact CE2-CD1 4.07Å; Y54-I66 HydrophobicContact CE2-CG1 3.86Å; Y54-I66 HydrophobicContact CG-CD1 3.79Å; Y54-I66 HydrophobicContact CG-CG1 3.84Å
55	C	87	Confident	84.7	Confident	39 Å²	39	82.9 Å²	82.9	26%	0.264	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	120.7	177.7	-174.1	0	0	0	0	110.3	M48 V57 L62	M48-C55 WeakPolarHBondContact CB-O 3.33Å; M48-C55 WeakPolarHBondContact CG-O 3.42Å; M48-C55 PolarHBondContact O-N 2.67Å; C55-V57 PolarHBondContact O-N 3.08Å; C55-L62 HydrophobicContact CB-CD2 3.87Å
56	C	86.9	Confident	84.8	Confident	1 Å²	1	84.3 Å²	84.3	1%	0.007	41%	0.41	C	S	.	.	P	Polyproline II helix	trans	-69.6	119.8	176.2	-173.3	0	0	0	0	110.7	L33 H38 L58 C59 N60 E61	L33-C56 HydrophobicContact CD1-CB 3.76Å; H38-C56 PolarHBondContact ND1-SG 3.32Å; H38-C56 VanDerWaalsContact ND1-SG 3.4Å; C56-L58 PolarHBondContact O-N 3.24Å; C56-C59 VanDerWaalsContact SG-SG 3.62Å; C56-N60 WeakPolarHBondContact O-CA 3.22Å; C56-N60 PolarHBondContact O-N 3.35Å; C56-N60 PolarHBondContact O-OD1 2.9Å; C56-E61 PolarHBondContact N-O 3.09Å
57	V	84.8	Confident	84.7	Confident	53 Å²	53	83.5 Å²	83.5	32%	0.321	41%	0.408	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68	-16.2	178.9	-59.6	0	0	0	0	114.2	V23 M48 C55	V23-V57 HydrophobicContact CG2-CG2 3.57Å; M48-V57 HydrophobicContact CE-CG2 4.07Å; M48-V57 HydrophobicContact CG-CG1 4.14Å; C55-V57 PolarHBondContact O-N 3.08Å
58	L	82.9	Confident	84.3	Confident	58 Å²	58	80.1 Å²	80.1	30%	0.304	41%	0.408	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88	-43.7	-178.9	-64	-171.9	0	0	0	113	C56	C56-L58 PolarHBondContact O-N 3.24Å
59	C	86.2	Confident	83.8	Confident	49 Å²	49	81.5 Å²	81.5	33%	0.331	42%	0.415	S	S	.	.	T	Hydrogen-bonded Turn	trans	-119.4	-1	-176	65.1	0	0	0	0	114.3	C36 C56 E61	C36-C59 WeakPolarHBondContact CB-SG 3.38Å; C36-C59 VanDerWaalsContact SG-SG 3.65Å; C56-C59 VanDerWaalsContact SG-SG 3.62Å; C59-E61 PolarHBondContact O-N 2.94Å; C59-E61 VanDerWaalsContact O-N 3.11Å
60	N	86.8	Confident	82.9	Confident	119 Å²	119	78.9 Å²	78.9	64%	0.636	42%	0.415	S	S	*	.			trans	59.5	12	-176.4	-65.4	-28.7	0	0	0	115.8	C56	C56-N60 WeakPolarHBondContact O-CA 3.22Å; C56-N60 PolarHBondContact O-N 3.35Å; C56-N60 PolarHBondContact O-OD1 2.9Å
61	E	87.7	Confident	82.2	Confident	87 Å²	87	74.7 Å²	74.7	41%	0.407	40%	0.399	S	S	.	.			trans	-71.3	142.1	174.3	-70.5	-171.1	-166.3	0	0	112.1	A35 C36 C56 C59	A35-E61 HydrophobicContact CB-CB 4.07Å; A35-E61 WeakPolarHBondContact CB-OE2 3.36Å; C36-E61 WeakPolarHBondContact CA-OE2 3.44Å; C36-E61 HydrophobicContact CB-CB 4.16Å; C36-E61 HydrophobicContact CB-CG 4.43Å; C36-E61 WeakPolarHBondContact CB-OE2 3.42Å; C36-E61 PolarHBondContact N-OE2 2.9Å; C56-E61 PolarHBondContact N-O 3.09Å; C59-E61 PolarHBondContact O-N 2.94Å; C59-E61 VanDerWaalsContact O-N 3.11Å
62	L	89.4	Confident	81.2	Confident	111 Å²	111	70.4 Å²	70.4	58%	0.581	38%	0.376	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.2	121.2	-177	-67	164.1	0	0	0	110.1	V53 Y54 C55	V53-L62 HydrophobicContact CG2-CD2 4.13Å; Y54-L62 WeakPolarHBondContact O-CA 3.38Å; C55-L62 HydrophobicContact CB-CD2 3.87Å
63	S	87.9	Confident	80	Confident	2 Å²	2	65.3 Å²	65.3	1%	0.014	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	127.4	172.6	-68.4	0	0	0	0	110.4	P34 A35 Y54 K65	P34-S63 WeakPolarHBondContact CD-OG 3.42Å; A35-S63 WeakPolarHBondContact CB-OG 3.35Å; A35-S63 PolarHBondContact N-OG 3.11Å; Y54-S63 PolarHBondContact N-O 3.1Å; Y54-S63 PolarHBondContact O-N 3.33Å; S63-K65 VanDerWaalsContact C-N 3.33Å
64	Q	86.4	Confident	78.3	Confident	159 Å²	159	66.8 Å²	66.8	74%	0.743	36%	0.356	S	S	*	.	S	Bend	trans	-71.9	-28.9	178.3	-66	178.8	-3.6	0	0	112.9
65	K	83.4	Confident	76.5	Confident	158 Å²	158	67.7 Å²	67.7	69%	0.687	37%	0.368	S	S	*	.	S	Bend	trans	-141.5	154.7	-176.9	-64.1	-177.4	-179	177.9	0	109.6	P34 S63	P34-K65 WeakPolarHBondContact CD-O 3.34Å; P34-K65 VanDerWaalsContact CG-O 3.26Å; P34-K65 WeakPolarHBondContact CG-O 3.32Å; S63-K65 VanDerWaalsContact C-N 3.33Å
66	I	83.9	Confident	74.4	Confident	39 Å²	39	71.4 Å²	71.4	20%	0.2	38%	0.381	C	S	.	.	P	Polyproline II helix	trans	-101.4	130.7	172.3	-71.1	-179.4	0	0	0	108.6	L33 A45 Y54	L33-I66 HydrophobicContact CD2-CG1 4.19Å; A45-I66 HydrophobicContact CB-CD1 3.57Å; Y54-I66 HydrophobicContact CD1-CD1 3.42Å; Y54-I66 VanDerWaalsContact CD1-CD1 3.42Å; Y54-I66 HydrophobicContact CD1-CG1 4.01Å; Y54-I66 HydrophobicContact CD2-CD1 4.11Å; Y54-I66 HydrophobicContact CD2-CG1 3.77Å; Y54-I66 HydrophobicContact CE1-CD1 3.35Å; Y54-I66 HydrophobicContact CE1-CG1 4.08Å; Y54-I66 HydrophobicContact CE2-CD1 4.07Å; Y54-I66 HydrophobicContact CE2-CG1 3.86Å; Y54-I66 HydrophobicContact CG-CD1 3.79Å; Y54-I66 HydrophobicContact CG-CG1 3.84Å
67	I	80.2	Confident	72.2	Confident	90 Å²	90	78.8 Å²	78.8	46%	0.462	42%	0.42	S	S	.	.	B	Isolated β-bridge	trans	-86.7	117.6	171.7	-59.8	173.9	0	0	0	107.6	I32 P34	I32-I67 HydrophobicContact CB-CB 4.27Å; I32-I67 PolarHBondContact N-O 3.49Å; I32-I67 PolarHBondContact O-N 3.44Å; P34-I67 HydrophobicContact CB-CD1 4Å
68	S	74.2	Confident	70.2	Confident	88 Å²	88	80.1 Å²	80.1	62%	0.615	43%	0.429	S	S	*	.	P	Polyproline II helix	trans	-96.1	120.1	173.4	-57.5	0	0	0	0	109.8	F30	F30-S68 VanDerWaalsContact O-CA 3.29Å; F30-S68 WeakPolarHBondContact O-CA 3.47Å; F30-S68 PolarHBondContact O-OG 3.18Å
69	N	72.9	Confident	68.3	Low	40 Å²	40	84.2 Å²	84.2	21%	0.214	45%	0.451	C	S	.	.			trans	-126.1	97.3	176.6	-173.8	-34.9	0	0	0	110.5	I32 N71 I72 C73	I32-N69 HydrophobicContact CD1-CB 4.45Å; N69-N71 PolarHBondContact O-N 2.9Å; N69-N71 WeakPolarHBondContact OD1-CB 3.39Å; N69-N71 PolarHBondContact OD1-N 2.82Å; N69-N71 VanDerWaalsContact OD1-N 3.11Å; N69-I72 HydrophobicContact CB-CB 4.34Å; N69-I72 HydrophobicContact CB-CD1 3.94Å; N69-I72 HydrophobicContact CB-CG1 4.17Å; N69-I72 PolarHBondContact O-N 3.37Å; N69-I72 VanDerWaalsContact O-N 3.07Å; N69-I72 PolarHBondContact OD1-N 3.27Å; N69-C73 WeakPolarHBondContact O-CB 3.37Å; N69-C73 PolarHBondContact O-N 3.11Å; N69-C73 VanDerWaalsContact O-N 3.15Å; N69-C73 PolarHBondContact O-SG 3.41Å
70	P	65.3	Low	66.1	Low	75 Å²	75	91.2 Å²	91.2	49%	0.487	48%	0.476	S	S	.	.	H	α-helix	trans	-54.1	-30	-175.7	-27.1	34.4	0	0	0	115	C73 N74	P70-C73 PolarHBondContact O-N 3.31Å; P70-N74 PolarHBondContact O-N 2.97Å
71	N	64.5	Low	64.4	Low	56 Å²	56	86.7 Å²	86.7	30%	0.299	45%	0.454	S	S	.	.	H	α-helix	trans	-73.3	-34.8	-178.8	-72.1	-14.7	0	0	0	112.8	N69 L135 G136 L138	N69-N71 PolarHBondContact O-N 2.9Å; N69-N71 WeakPolarHBondContact OD1-CB 3.39Å; N69-N71 PolarHBondContact OD1-N 2.82Å; N69-N71 VanDerWaalsContact OD1-N 3.11Å; N71-L135 PolarHBondContact OD1-O 3.31Å; N71-G136 PolarHBondContact ND2-O 3.33Å; N71-G136 VanDerWaalsContact ND2-O 3.11Å; N71-L138 PolarHBondContact ND2-N 2.69Å
72	I	59.6	Low	63.3	Low	54 Å²	54	84.7 Å²	84.7	28%	0.277	45%	0.448	S	S	.	.	H	α-helix	trans	-73.3	-37.9	175	-61.7	176.5	0	0	0	109.6	L19 I32 N69 N74 S75	L19-I72 HydrophobicContact CD1-CG2 4.32Å; L19-I72 HydrophobicContact CD2-CG2 3.49Å; L19-I72 VanDerWaalsContact CD2-CG2 3.49Å; L19-I72 HydrophobicContact CG-CG2 4.43Å; I32-I72 HydrophobicContact CD1-CD1 3.88Å; N69-I72 HydrophobicContact CB-CB 4.34Å; N69-I72 HydrophobicContact CB-CD1 3.94Å; N69-I72 HydrophobicContact CB-CG1 4.17Å; N69-I72 PolarHBondContact O-N 3.37Å; N69-I72 VanDerWaalsContact O-N 3.07Å; N69-I72 PolarHBondContact OD1-N 3.27Å; I72-N74 PolarHBondContact O-N 2.91Å; I72-S75 PolarHBondContact O-OG 3.28Å
73	C	55.7	Low	62.6	Low	6 Å²	6	82.1 Å²	82.1	4%	0.041	44%	0.437	C	S	.	.	H	α-helix	trans	-68	-28	-174	-69.3	0	0	0	0	115.1	V29 F30 N69 P70	V29-C73 HydrophobicContact CG1-CB 4.4Å; V29-C73 WeakPolarHBondContact O-CA 3.32Å; V29-C73 WeakPolarHBondContact O-CB 3.41Å; V29-C73 PolarHBondContact O-SG 3.43Å; F30-C73 WeakPolarHBondContact CA-SG 3.35Å; N69-C73 WeakPolarHBondContact O-CB 3.37Å; N69-C73 PolarHBondContact O-N 3.11Å; N69-C73 VanDerWaalsContact O-N 3.15Å; N69-C73 PolarHBondContact O-SG 3.41Å; P70-C73 PolarHBondContact O-N 3.31Å
74	N	52.5	Low	62.3	Low	79 Å²	79	82 Å²	82	42%	0.422	44%	0.436	S	S	.	.	T	Hydrogen-bonded Turn	trans	-114	22	-171.1	-74.2	-17.6	0	0	0	114.7	P70 I72 E76 N77	P70-N74 PolarHBondContact O-N 2.97Å; I72-N74 PolarHBondContact O-N 2.91Å; N74-E76 PolarHBondContact O-N 2.91Å; N74-N77 PolarHBondContact O-N 3.44Å
75	S	47.7	Very low	62.1	Low	59 Å²	59	77 Å²	77	41%	0.413	42%	0.415	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.1	7.3	-165.3	57.4	0	0	0	0	117.6	I72	I72-S75 PolarHBondContact O-OG 3.28Å
76	E	44.3	Very low	62	Low	117 Å²	117	73 Å²	73	55%	0.547	40%	0.396	S	S	.	.	T	Hydrogen-bonded Turn	trans	-132	16.6	173.7	-81.2	-168.4	158.1	0	0	117.7	R27 N74 T78	R27-E76 IonicContact CZ-OE2 3.8Å; R27-E76 IonicContact NH1-OE2 3.14Å; R27-E76 PolarHBondContact NH1-OE2 3.24Å; N74-E76 PolarHBondContact O-N 2.91Å; E76-T78 PolarHBondContact O-N 2.97Å
77	N	39.9	Very low	62	Low	155 Å²	155	71.6 Å²	71.6	83%	0.829	39%	0.389	S	S	*	.	S	Bend	trans	-78.4	4.3	159.7	-94.6	10.8	0	0	0	113.5	N74	N74-N77 PolarHBondContact O-N 3.44Å
78	T	43.2	Very low	62.1	Low	82 Å²	82	72.3 Å²	72.3	50%	0.503	39%	0.39	S	S	.	.	S	Bend	trans	-99.5	-14	-174.3	49.9	0	0	0	0	116.1	E76	E76-T78 PolarHBondContact O-N 2.97Å
79	N	41.8	Very low	62.2	Low	143 Å²	143	74 Å²	74	77%	0.765	39%	0.392	S	S	*	.	S	Bend	trans	-117.6	19.8	-169.7	-85.9	-9.5	0	0	0	117.7
80	K	41.1	Very low	62.4	Low	196 Å²	196	78.3 Å²	78.3	85%	0.852	42%	0.415	S	S	*	.			trans	-141.2	55.4	157	-65.4	-174.5	-175.6	175.7	0	111.5	P82	K80-P82 WeakPolarHBondContact O-CD 3.46Å
81	S	50.4	Low	63	Low	24 Å²	24	78 Å²	78	17%	0.168	43%	0.426	C	S	.	.			trans	-68.1	113.2	146.7	56.1	0	0	0	0	105.2	T83 K95	S81-T83 PolarHBondContact O-N 3.38Å; S81-K95 WeakPolarHBondContact OG-CD 3.38Å; S81-K95 WeakPolarHBondContact OG-CE 3.2Å; S81-K95 WeakPolarHBondContact OG-CG 3.36Å
82	P	65.5	Low	63.7	Low	45 Å²	45	80.7 Å²	80.7	29%	0.292	44%	0.437	S	S	.	.	P	Polyproline II helix	trans	-54	145.5	178.2	20.3	-31.5	0	0	0	110.2	K80 S96 W106	K80-P82 WeakPolarHBondContact O-CD 3.46Å; P82-S96 WeakPolarHBondContact O-CB 3.46Å; P82-S96 PolarHBondContact O-N 3.22Å; P82-S96 PolarHBondContact O-OG 3.06Å; P82-W106 HydrophobicContact CB-CB 4.34Å; P82-W106 HydrophobicContact CB-CD2 4.2Å; P82-W106 HydrophobicContact CB-CG 3.94Å; P82-W106 HydrophobicContact CG-CB 3.98Å; P82-W106 HydrophobicContact CG-CD2 3.08Å; P82-W106 HydrophobicContact CG-CE3 3.48Å; P82-W106 VanDerWaalsContact CG-CE3 3.48Å; P82-W106 HydrophobicContact CG-CG 3.31Å; P82-W106 HydrophobicContact CG-CH2 4.21Å; P82-W106 HydrophobicContact CG-CZ2 3.88Å; P82-W106 HydrophobicContact CG-CZ3 4.03Å
83	T	74.5	Confident	64.4	Low	57 Å²	57	86.2 Å²	86.2	35%	0.35	46%	0.462	S	S	.	.	B	Isolated β-bridge	trans	-61	146.8	174.4	42.6	0	0	0	0	110	S81 N85 Q93 T94 S96	S81-T83 PolarHBondContact O-N 3.38Å; T83-N85 PolarHBondContact O-N 3.42Å; T83-Q93 HydrophobicContact CG2-CB 4.17Å; T83-Q93 HydrophobicContact CG2-CG 4.46Å; T83-T94 CarbonylContact C-O 3Å; T83-T94 WeakPolarHBondContact CA-O 3.45Å; T83-S96 VanDerWaalsContact C-OG 3.22Å; T83-S96 PolarHBondContact O-OG 2.99Å
84	C	82.3	Confident	65.3	Low	0 Å²	0	88 Å²	88	0%	0	47%	0.473	C	S	.	.	P	Polyproline II helix	trans	-59.1	121	178.1	171.8	0	0	0	0	109.4	W86 C87 H88 T94 S96 W106 C108	C84-W86 VanDerWaalsContact C-N 3.28Å; C84-W86 PolarHBondContact O-N 3.41Å; C84-C87 HydrophobicContact CB-CB 3.87Å; C84-C87 PolarHBondContact O-N 3.06Å; C84-C87 PolarHBondContact SG-N 3.42Å; C84-H88 VanDerWaalsContact O-CB 3.23Å; C84-H88 WeakPolarHBondContact O-CB 3.38Å; C84-H88 PolarHBondContact O-N 2.9Å; C84-T94 WeakPolarHBondContact CB-OG1 3.45Å; C84-T94 PolarHBondContact N-O 3.45Å; C84-S96 WeakPolarHBondContact CA-OG 3.37Å; C84-S96 PolarHBondContact N-OG 3.33Å; C84-W106 CarbonylContact C-O 3.47Å; C84-W106 WeakPolarHBondContact CA-O 3.49Å; C84-C108 HydrophobicContact CB-CB 3.79Å; C84-C108 PolarHBondContact SG-N 2.68Å
85	N	82.3	Confident	66.3	Low	54 Å²	54	90.7 Å²	90.7	29%	0.289	48%	0.48	S	S	.	.	H	α-helix	trans	-55.6	-45.4	-177.4	-69.4	52.4	0	0	0	110.8	T83 H88 D89 I105 W106	T83-N85 PolarHBondContact O-N 3.42Å; N85-H88 PolarHBondContact O-N 2.77Å; N85-D89 PolarHBondContact O-N 3.01Å; N85-I105 HydrophobicContact CB-CB 4.34Å; N85-I105 HydrophobicContact CB-CG2 4.46Å; N85-W106 PolarHBondContact N-O 3.03Å; N85-W106 WeakPolarHBondContact OD1-CB 3.32Å; N85-W106 PolarHBondContact OD1-N 2.95Å; N85-W106 VanDerWaalsContact OD1-N 3.07Å; N85-W106 PolarHBondContact OD1-O 3.36Å
86	W	80.4	Confident	67.8	Low	75 Å²	75	88.1 Å²	88.1	28%	0.284	46%	0.462	S	S	.	.	H	α-helix	trans	-71.9	-32.5	-178.3	-65.3	-6.1	0	0	0	114.1	C84 N90 I105 L107 C111 H115 M118 L121	C84-W86 VanDerWaalsContact C-N 3.28Å; C84-W86 PolarHBondContact O-N 3.41Å; W86-N90 PolarHBondContact O-N 3.26Å; W86-N90 PolarHBondContact O-ND2 3.39Å; W86-I105 HydrophobicContact CZ2-CD1 3.74Å; W86-L107 HydrophobicContact CB-CD2 4.46Å; W86-L107 HydrophobicContact CD2-CD2 3.54Å; W86-L107 HydrophobicContact CE3-CD2 3.81Å; W86-L107 HydrophobicContact CG-CD2 3.84Å; W86-L107 HydrophobicContact CZ2-CD2 4.33Å; W86-L107 HydrophobicContact CZ3-CD2 4.3Å; W86-C111 HydrophobicContact CE3-CB 3.86Å; W86-C111 HydrophobicContact CZ3-CB 4.5Å; W86-H115 HydrophobicContact CH2-CB 4.03Å; W86-H115 AromaticContact CH2-CD2 3.68Å; W86-H115 HydrophobicContact CZ3-CB 4.22Å; W86-M118 HydrophobicContact CH2-CE 3.57Å; W86-M118 HydrophobicContact CZ2-CE 4.46Å; W86-M118 HydrophobicContact CZ3-CE 4.17Å; W86-L121 HydrophobicContact CH2-CD1 4.45Å
87	C	84.3	Confident	69.5	Low	9 Å²	9	84.6 Å²	84.6	6%	0.061	45%	0.449	C	S	.	.	H	α-helix	trans	-73.4	-38.8	172.5	-72.9	0	0	0	0	110.4	C84 D89 N90 G91 E92 T94 C111	C84-C87 HydrophobicContact CB-CB 3.87Å; C84-C87 PolarHBondContact O-N 3.06Å; C84-C87 PolarHBondContact SG-N 3.42Å; C87-D89 VanDerWaalsContact C-N 3.34Å; C87-D89 PolarHBondContact O-N 3.46Å; C87-N90 CarbonylContact O-C 3.54Å; C87-N90 WeakPolarHBondContact O-CA 3.32Å; C87-N90 WeakPolarHBondContact O-CB 3.35Å; C87-N90 PolarHBondContact O-N 2.84Å; C87-G91 PolarHBondContact O-N 2.99Å; C87-G91 VanDerWaalsContact O-N 3.1Å; C87-E92 CarbonylContact C-O 3.59Å; C87-E92 HydrophobicContact CB-CB 3.95Å; C87-E92 WeakPolarHBondContact CB-O 3.35Å; C87-E92 WeakPolarHBondContact O-CA 3.41Å; C87-E92 PolarHBondContact O-N 3.17Å; C87-E92 VanDerWaalsContact O-O 3.07Å; C87-T94 HydrophobicContact CB-CG2 4.15Å; C87-T94 WeakPolarHBondContact CB-OG1 3.28Å; C87-T94 PolarHBondContact SG-OG1 3.07Å; C87-C111 VanDerWaalsContact SG-SG 3.64Å
88	H	80.8	Confident	71.3	Confident	104 Å²	104	77.2 Å²	77.2	48%	0.481	41%	0.409	S	S	.	.	H	α-helix	trans	-62.4	-42.2	177.4	179.2	-81.2	0	0	0	111.4	C84 N85 N90 G91 E92	C84-H88 VanDerWaalsContact O-CB 3.23Å; C84-H88 WeakPolarHBondContact O-CB 3.38Å; C84-H88 PolarHBondContact O-N 2.9Å; N85-H88 PolarHBondContact O-N 2.77Å; H88-N90 PolarHBondContact O-N 3.11Å; H88-G91 PolarHBondContact O-N 3.32Å; H88-E92 WeakPolarHBondContact CA-O 3.21Å; H88-E92 PolarHBondContact N-O 3.23Å; H88-E92 VanDerWaalsContact N-O 3.13Å
89	D	77.6	Confident	73	Confident	123 Å²	123	74.5 Å²	74.5	66%	0.658	39%	0.391	S	S	*	.	H	α-helix	trans	-60.9	-29	173.5	-66.8	-19.2	0	0	0	112.3	N85 C87	N85-D89 PolarHBondContact O-N 3.01Å; C87-D89 VanDerWaalsContact C-N 3.34Å; C87-D89 PolarHBondContact O-N 3.46Å
90	N	77.8	Confident	74.9	Confident	131 Å²	131	67.7 Å²	67.7	70%	0.701	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.4	3.8	174.2	-68.2	-17	0	0	0	113.8	W86 C87 H88	W86-N90 PolarHBondContact O-N 3.26Å; W86-N90 PolarHBondContact O-ND2 3.39Å; C87-N90 CarbonylContact O-C 3.54Å; C87-N90 WeakPolarHBondContact O-CA 3.32Å; C87-N90 WeakPolarHBondContact O-CB 3.35Å; C87-N90 PolarHBondContact O-N 2.84Å; H88-N90 PolarHBondContact O-N 3.11Å
91	G	76.2	Confident	76.7	Confident	70 Å²	70	63.2 Å²	63.2	72%	0.722	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.8	7.3	-179.2	0	0	0	0	0	115.7	C87 H88	C87-G91 PolarHBondContact O-N 2.99Å; C87-G91 VanDerWaalsContact O-N 3.1Å; H88-G91 PolarHBondContact O-N 3.32Å
92	E	79.2	Confident	77.9	Confident	112 Å²	112	66.8 Å²	66.8	52%	0.523	35%	0.354	S	S	.	.			trans	-103.7	129.4	179.4	-66.8	178.1	177.1	0	0	112.2	C87 H88 T94	C87-E92 CarbonylContact C-O 3.59Å; C87-E92 HydrophobicContact CB-CB 3.95Å; C87-E92 WeakPolarHBondContact CB-O 3.35Å; C87-E92 WeakPolarHBondContact O-CA 3.41Å; C87-E92 PolarHBondContact O-N 3.17Å; C87-E92 VanDerWaalsContact O-O 3.07Å; H88-E92 WeakPolarHBondContact CA-O 3.21Å; H88-E92 PolarHBondContact N-O 3.23Å; H88-E92 VanDerWaalsContact N-O 3.13Å; E92-T94 HydrophobicContact CB-CG2 4.38Å; E92-T94 PolarHBondContact O-N 2.92Å
93	Q	74.8	Confident	78.7	Confident	170 Å²	170	66.7 Å²	66.7	79%	0.794	35%	0.354	S	S	*	.			trans	-92.2	72.4	174.9	-66.1	-179.1	12.6	0	0	111.3	T83	T83-Q93 HydrophobicContact CG2-CB 4.17Å; T83-Q93 HydrophobicContact CG2-CG 4.46Å
94	T	74.2	Confident	79	Confident	44 Å²	44	69.7 Å²	69.7	27%	0.27	37%	0.368	S	S	.	.	P	Polyproline II helix	trans	-90.1	142.2	174.6	64	0	0	0	0	111.8	T83 C84 C87 E92 S96 C108	T83-T94 CarbonylContact C-O 3Å; T83-T94 WeakPolarHBondContact CA-O 3.45Å; C84-T94 WeakPolarHBondContact CB-OG1 3.45Å; C84-T94 PolarHBondContact N-O 3.45Å; C87-T94 HydrophobicContact CB-CG2 4.15Å; C87-T94 WeakPolarHBondContact CB-OG1 3.28Å; C87-T94 PolarHBondContact SG-OG1 3.07Å; E92-T94 HydrophobicContact CB-CG2 4.38Å; E92-T94 PolarHBondContact O-N 2.92Å; T94-S96 PolarHBondContact O-N 3.4Å; T94-C108 WeakPolarHBondContact OG1-CB 3.49Å
95	K	75.2	Confident	79.1	Confident	135 Å²	135	71 Å²	71	59%	0.587	37%	0.374	S	S	*	.	B	Isolated β-bridge	trans	-68.5	128.4	179.9	-161.1	-178.9	-176.4	174.5	0	110.7	S81 C108	S81-K95 WeakPolarHBondContact OG-CD 3.38Å; S81-K95 WeakPolarHBondContact OG-CE 3.2Å; S81-K95 WeakPolarHBondContact OG-CG 3.36Å; K95-C108 WeakPolarHBondContact O-CA 3.4Å; K95-C108 WeakPolarHBondContact O-CB 3.36Å
96	S	77.7	Confident	79.2	Confident	4 Å²	4	72.1 Å²	72.1	3%	0.028	38%	0.375	C	S	.	.	P	Polyproline II helix	trans	-71.2	136.9	174.5	-60.2	0	0	0	0	111.8	P82 T83 C84 T94 W106 L107	P82-S96 WeakPolarHBondContact O-CB 3.46Å; P82-S96 PolarHBondContact O-N 3.22Å; P82-S96 PolarHBondContact O-OG 3.06Å; T83-S96 VanDerWaalsContact C-OG 3.22Å; T83-S96 PolarHBondContact O-OG 2.99Å; C84-S96 WeakPolarHBondContact CA-OG 3.37Å; C84-S96 PolarHBondContact N-OG 3.33Å; T94-S96 PolarHBondContact O-N 3.4Å; S96-W106 VanDerWaalsContact OG-CB 3.26Å; S96-W106 WeakPolarHBondContact OG-CB 3.34Å; S96-L107 CarbonylContact C-O 3.59Å; S96-L107 WeakPolarHBondContact CA-O 3.46Å
97	T	80.2	Confident	79.3	Confident	43 Å²	43	68.6 Å²	68.6	26%	0.264	36%	0.361	S	S	.	.			trans	-99.8	-15.8	174.5	53.3	0	0	0	0	112.7	L107 C108 G109 L129	T97-L107 PolarHBondContact N-O 2.95Å; T97-L107 PolarHBondContact OG1-O 3.29Å; T97-C108 VanDerWaalsContact OG1-C 3.23Å; T97-G109 VanDerWaalsContact OG1-CA 3.27Å; T97-G109 WeakPolarHBondContact OG1-CA 3.18Å; T97-G109 PolarHBondContact OG1-N 3.32Å; T97-L129 PolarHBondContact O-N 3.4Å; T97-L129 VanDerWaalsContact O-O 3.13Å
98	G	77.4	Confident	79.3	Confident	0 Å²	0	68.6 Å²	68.6	0%	0	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.2	159.4	179.5	0	0	0	0	0	112.5	L107 T127	G98-L107 PolarHBondContact N-O 3.23Å; G98-L107 PolarHBondContact O-N 3.16Å; G98-T127 WeakPolarHBondContact CA-O 3.4Å
99	H	80.1	Confident	79.3	Confident	26 Å²	26	65 Å²	65	12%	0.12	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	130.2	172.8	-176.9	65.1	0	0	0	108.8	D104 I105 W106 I126 T127	H99-D104 IonicContact CE1-OD1 3.66Å; H99-D104 PolarHBondContact CE1-OD1 3.1Å; H99-D104 IonicContact NE2-OD1 3.87Å; H99-D104 PolarHBondContact NE2-OD1 3.04Å; H99-I105 WeakPolarHBondContact CA-O 3.48Å; H99-I105 PolarHBondContact ND1-O 3.48Å; H99-W106 HydrophobicContact CB-CD2 3.96Å; H99-W106 HydrophobicContact CB-CE3 3.6Å; H99-W106 HydrophobicContact CB-CH2 3.89Å; H99-W106 HydrophobicContact CB-CZ2 4.24Å; H99-W106 HydrophobicContact CB-CZ3 3.54Å; H99-W106 AromaticContact CE1-NE1 3.97Å; H99-W106 AromaticContact CG-CE2 3.98Å; H99-W106 AromaticContact ND1-CD1 3.87Å; H99-W106 AromaticContact ND1-CD2 3.58Å; H99-W106 AromaticContact ND1-CE2 3.39Å; H99-W106 AromaticContact ND1-CG 3.91Å; H99-W106 AromaticContact ND1-CZ2 3.86Å; H99-W106 AromaticContact ND1-NE1 3.52Å; H99-I126 CarbonylContact O-C 3.54Å; H99-I126 WeakPolarHBondContact O-CA 3.49Å; H99-T127 PolarHBondContact N-O 3.03Å; H99-T127 PolarHBondContact O-N 3.25Å
100	C	80.2	Confident	79.4	Confident	0 Å²	0	66.6 Å²	66.6	0%	0	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	111.3	170.6	-180	0	0	0	0	108.1	D102 C103 D104 I105 H115 H124 I126	C100-D102 VanDerWaalsContact C-N 3.3Å; C100-D102 PolarHBondContact O-N 2.89Å; C100-C103 HydrophobicContact CB-CB 4.02Å; C100-C103 PolarHBondContact O-N 2.82Å; C100-D104 WeakPolarHBondContact O-CA 3.49Å; C100-D104 PolarHBondContact O-N 3.14Å; C100-I105 HydrophobicContact CB-CG1 4.29Å; C100-I105 PolarHBondContact N-O 3Å; C100-I105 PolarHBondContact O-N 3.16Å; C100-H115 PolarHBondContact SG-CE1 3.46Å; C100-H124 WeakPolarHBondContact SG-CB 3.38Å; C100-H124 PolarHBondContact SG-ND1 3.41Å; C100-H124 VanDerWaalsContact SG-ND1 3.35Å; C100-I126 HydrophobicContact CB-CG1 4.31Å
101	E	80.2	Confident	79.8	Confident	101 Å²	101	61.5 Å²	61.5	47%	0.472	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-34.3	-177.9	-63.2	-169.6	166.3	0	0	111.8	C103 N125 T127	E101-C103 VanDerWaalsContact C-N 3.33Å; E101-C103 PolarHBondContact O-N 3.41Å; E101-N125 HydrophobicContact CB-CB 4.48Å; E101-N125 PolarHBondContact N-O 3.43Å; E101-N125 PolarHBondContact OE2-ND2 3.15Å; E101-T127 VanDerWaalsContact CD-OG1 3.31Å; E101-T127 PolarHBondContact OE1-OG1 2.85Å
102	D	75.7	Confident	80.2	Confident	100 Å²	100	58.9 Å²	58.9	54%	0.535	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.9	-21.6	-179.8	-62.9	-44.5	0	0	0	113.9	C100 H124 N125	C100-D102 VanDerWaalsContact C-N 3.3Å; C100-D102 PolarHBondContact O-N 2.89Å; D102-H124 HydrophobicContact CB-CB 4Å; D102-H124 WeakPolarHBondContact OD2-CA 3.47Å; D102-H124 WeakPolarHBondContact OD2-CB 3.46Å; D102-H124 IonicContact OD2-CD2 3.19Å; D102-H124 IonicContact OD2-CG 2.91Å; D102-N125 PolarHBondContact OD2-N 2.71Å
103	C	81.3	Confident	80.3	Confident	43 Å²	43	60 Å²	60	29%	0.291	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.7	-11.6	176.4	-72.2	0	0	0	0	112.5	C100 E101 I105 H115 H124	C100-C103 HydrophobicContact CB-CB 4.02Å; C100-C103 PolarHBondContact O-N 2.82Å; E101-C103 VanDerWaalsContact C-N 3.33Å; E101-C103 PolarHBondContact O-N 3.41Å; C103-I105 VanDerWaalsContact C-N 3.27Å; C103-I105 HydrophobicContact CB-CD1 3.76Å; C103-I105 HydrophobicContact CB-CG1 3.6Å; C103-I105 WeakPolarHBondContact O-CG2 3.37Å; C103-I105 PolarHBondContact O-N 3.34Å; C103-H115 PolarHBondContact SG-NE2 3.3Å; C103-H115 VanDerWaalsContact SG-NE2 3.41Å; C103-H124 PolarHBondContact SG-CE1 3.41Å; C103-H124 PolarHBondContact SG-ND1 2.96Å
104	D	80.9	Confident	80.6	Confident	120 Å²	120	53.3 Å²	53.3	64%	0.642	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.5	42.7	-169.7	-164.2	26.8	0	0	0	113.9	H99 C100	H99-D104 IonicContact CE1-OD1 3.66Å; H99-D104 PolarHBondContact CE1-OD1 3.1Å; H99-D104 IonicContact NE2-OD1 3.87Å; H99-D104 PolarHBondContact NE2-OD1 3.04Å; C100-D104 WeakPolarHBondContact O-CA 3.49Å; C100-D104 PolarHBondContact O-N 3.14Å
105	I	84.3	Confident	81.1	Confident	28 Å²	28	51.2 Å²	51.2	14%	0.144	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	149.7	-178.9	61.3	-176.9	0	0	0	113	N85 W86 H99 C100 C103 L107	N85-I105 HydrophobicContact CB-CB 4.34Å; N85-I105 HydrophobicContact CB-CG2 4.46Å; W86-I105 HydrophobicContact CZ2-CD1 3.74Å; H99-I105 WeakPolarHBondContact CA-O 3.48Å; H99-I105 PolarHBondContact ND1-O 3.48Å; C100-I105 HydrophobicContact CB-CG1 4.29Å; C100-I105 PolarHBondContact N-O 3Å; C100-I105 PolarHBondContact O-N 3.16Å; C103-I105 VanDerWaalsContact C-N 3.27Å; C103-I105 HydrophobicContact CB-CD1 3.76Å; C103-I105 HydrophobicContact CB-CG1 3.6Å; C103-I105 WeakPolarHBondContact O-CG2 3.37Å; C103-I105 PolarHBondContact O-N 3.34Å; I105-L107 HydrophobicContact CD1-CD1 4.21Å; I105-L107 HydrophobicContact CD1-CD2 3.95Å; I105-L107 HydrophobicContact CD1-CG 4.27Å; I105-L107 HydrophobicContact CG1-CD1 4.27Å; I105-L107 HydrophobicContact CG1-CD2 4.24Å; I105-L107 HydrophobicContact CG1-CG 4.14Å
106	W	85.2	Confident	81.4	Confident	77 Å²	77	47.8 Å²	47.8	29%	0.292	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	131.4	176.2	-60	90.3	0	0	0	110.6	P82 C84 N85 S96 H99 L129	P82-W106 HydrophobicContact CB-CB 4.34Å; P82-W106 HydrophobicContact CB-CD2 4.2Å; P82-W106 HydrophobicContact CB-CG 3.94Å; P82-W106 HydrophobicContact CG-CB 3.98Å; P82-W106 HydrophobicContact CG-CD2 3.08Å; P82-W106 HydrophobicContact CG-CE3 3.48Å; P82-W106 VanDerWaalsContact CG-CE3 3.48Å; P82-W106 HydrophobicContact CG-CG 3.31Å; P82-W106 HydrophobicContact CG-CH2 4.21Å; P82-W106 HydrophobicContact CG-CZ2 3.88Å; P82-W106 HydrophobicContact CG-CZ3 4.03Å; C84-W106 CarbonylContact C-O 3.47Å; C84-W106 WeakPolarHBondContact CA-O 3.49Å; N85-W106 PolarHBondContact N-O 3.03Å; N85-W106 WeakPolarHBondContact OD1-CB 3.32Å; N85-W106 PolarHBondContact OD1-N 2.95Å; N85-W106 VanDerWaalsContact OD1-N 3.07Å; N85-W106 PolarHBondContact OD1-O 3.36Å; S96-W106 VanDerWaalsContact OG-CB 3.26Å; S96-W106 WeakPolarHBondContact OG-CB 3.34Å; H99-W106 HydrophobicContact CB-CD2 3.96Å; H99-W106 HydrophobicContact CB-CE3 3.6Å; H99-W106 HydrophobicContact CB-CH2 3.89Å; H99-W106 HydrophobicContact CB-CZ2 4.24Å; H99-W106 HydrophobicContact CB-CZ3 3.54Å; H99-W106 AromaticContact CE1-NE1 3.97Å; H99-W106 AromaticContact CG-CE2 3.98Å; H99-W106 AromaticContact ND1-CD1 3.87Å; H99-W106 AromaticContact ND1-CD2 3.58Å; H99-W106 AromaticContact ND1-CE2 3.39Å; H99-W106 AromaticContact ND1-CG 3.91Å; H99-W106 AromaticContact ND1-CZ2 3.86Å; H99-W106 AromaticContact ND1-NE1 3.52Å; W106-L129 HydrophobicContact CE3-CD1 4.19Å; W106-L129 HydrophobicContact CH2-CD1 4.23Å; W106-L129 HydrophobicContact CZ3-CD1 3.36Å
107	L	82.1	Confident	81.7	Confident	0 Å²	0	56.8 Å²	56.8	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	135.7	-171.7	-60.7	171.9	0	0	0	111.3	W86 S96 T97 G98 I105 C111 L112 H115	W86-L107 HydrophobicContact CB-CD2 4.46Å; W86-L107 HydrophobicContact CD2-CD2 3.54Å; W86-L107 HydrophobicContact CE3-CD2 3.81Å; W86-L107 HydrophobicContact CG-CD2 3.84Å; W86-L107 HydrophobicContact CZ2-CD2 4.33Å; W86-L107 HydrophobicContact CZ3-CD2 4.3Å; S96-L107 CarbonylContact C-O 3.59Å; S96-L107 WeakPolarHBondContact CA-O 3.46Å; T97-L107 PolarHBondContact N-O 2.95Å; T97-L107 PolarHBondContact OG1-O 3.29Å; G98-L107 PolarHBondContact N-O 3.23Å; G98-L107 PolarHBondContact O-N 3.16Å; I105-L107 HydrophobicContact CD1-CD1 4.21Å; I105-L107 HydrophobicContact CD1-CD2 3.95Å; I105-L107 HydrophobicContact CD1-CG 4.27Å; I105-L107 HydrophobicContact CG1-CD1 4.27Å; I105-L107 HydrophobicContact CG1-CD2 4.24Å; I105-L107 HydrophobicContact CG1-CG 4.14Å; L107-C111 HydrophobicContact CB-CB 4.16Å; L107-C111 HydrophobicContact CD2-CB 3.96Å; L107-L112 HydrophobicContact CB-CB 4.28Å; L107-L112 HydrophobicContact CB-CD1 4.25Å; L107-L112 HydrophobicContact CD1-CD1 4.01Å; L107-H115 HydrophobicContact CD1-CB 3.79Å
108	C	85.4	Confident	81.7	Confident	9 Å²	9	58.5 Å²	58.5	6%	0.061	29%	0.294	C	S	.	.			trans	-70.4	168.5	169.1	74.4	0	0	0	0	111	C84 T94 K95 T97 E110 C111 L112	C84-C108 HydrophobicContact CB-CB 3.79Å; C84-C108 PolarHBondContact SG-N 2.68Å; T94-C108 WeakPolarHBondContact OG1-CB 3.49Å; K95-C108 WeakPolarHBondContact O-CA 3.4Å; K95-C108 WeakPolarHBondContact O-CB 3.36Å; T97-C108 VanDerWaalsContact OG1-C 3.23Å; C108-E110 PolarHBondContact O-N 3.42Å; C108-E110 VanDerWaalsContact O-N 3.1Å; C108-C111 PolarHBondContact O-N 3.25Å; C108-C111 PolarHBondContact SG-N 3.48Å; C108-C111 VanDerWaalsContact SG-N 3.43Å; C108-L112 VanDerWaalsContact O-CB 3.29Å; C108-L112 WeakPolarHBondContact O-CB 2.83Å; C108-L112 PolarHBondContact O-N 2.95Å
109	G	79.9	Confident	81.8	Confident	29 Å²	29	63.4 Å²	63.4	30%	0.299	33%	0.326	S	S	.	.	H	α-helix	trans	-61.1	-25.2	-175.2	0	0	0	0	0	114.3	T97 K113	T97-G109 VanDerWaalsContact OG1-CA 3.27Å; T97-G109 WeakPolarHBondContact OG1-CA 3.18Å; T97-G109 PolarHBondContact OG1-N 3.32Å; G109-K113 WeakPolarHBondContact O-CD 3.07Å; G109-K113 VanDerWaalsContact O-CG 3.26Å; G109-K113 WeakPolarHBondContact O-CG 3.48Å; G109-K113 PolarHBondContact O-N 3.17Å
110	E	80.4	Confident	81.9	Confident	157 Å²	157	67.2 Å²	67.2	73%	0.734	35%	0.353	S	S	*	.	H	α-helix	trans	-82.2	-46.7	176.2	-59.6	-163.3	152.2	0	0	111.9	C108 L112 K113 G114	C108-E110 PolarHBondContact O-N 3.42Å; C108-E110 VanDerWaalsContact O-N 3.1Å; E110-L112 VanDerWaalsContact C-N 3.25Å; E110-L112 PolarHBondContact O-N 3.3Å; E110-K113 PolarHBondContact O-N 2.98Å; E110-G114 PolarHBondContact O-N 3.47Å
111	C	84.8	Confident	82	Confident	24 Å²	24	68.9 Å²	68.9	16%	0.162	36%	0.361	C	S	.	.	H	α-helix	trans	-62.4	-34.6	175.5	-71	0	0	0	0	111.6	W86 C87 L107 C108 G114 H115	W86-C111 HydrophobicContact CE3-CB 3.86Å; W86-C111 HydrophobicContact CZ3-CB 4.5Å; C87-C111 VanDerWaalsContact SG-SG 3.64Å; L107-C111 HydrophobicContact CB-CB 4.16Å; L107-C111 HydrophobicContact CD2-CB 3.96Å; C108-C111 PolarHBondContact O-N 3.25Å; C108-C111 PolarHBondContact SG-N 3.48Å; C108-C111 VanDerWaalsContact SG-N 3.43Å; C111-G114 CarbonylContact O-C 3.57Å; C111-G114 PolarHBondContact O-N 2.91Å; C111-H115 WeakPolarHBondContact O-CB 3.48Å; C111-H115 PolarHBondContact O-N 3.38Å
112	L	84.2	Confident	81.9	Confident	15 Å²	15	71.1 Å²	71.1	8%	0.079	37%	0.365	C	S	.	.	H	α-helix	trans	-67.2	-39.6	176	-167.1	66.7	0	0	0	112.6	L107 C108 E110 G114 H115 N116 I126 L128	L107-L112 HydrophobicContact CB-CB 4.28Å; L107-L112 HydrophobicContact CB-CD1 4.25Å; L107-L112 HydrophobicContact CD1-CD1 4.01Å; C108-L112 VanDerWaalsContact O-CB 3.29Å; C108-L112 WeakPolarHBondContact O-CB 2.83Å; C108-L112 PolarHBondContact O-N 2.95Å; E110-L112 VanDerWaalsContact C-N 3.25Å; E110-L112 PolarHBondContact O-N 3.3Å; L112-G114 VanDerWaalsContact C-N 3.31Å; L112-H115 WeakPolarHBondContact O-CB 3.48Å; L112-H115 PolarHBondContact O-N 3.46Å; L112-N116 PolarHBondContact O-N 3.16Å; L112-I126 HydrophobicContact CD1-CD1 3.79Å; L112-I126 HydrophobicContact CD1-CG1 4.2Å; L112-I126 HydrophobicContact CD1-CG2 3.7Å; L112-I126 HydrophobicContact CD2-CG2 4.19Å; L112-L128 HydrophobicContact CD2-CD1 4.45Å; L112-L128 HydrophobicContact CD2-CG 4.32Å
113	K	82.9	Confident	82	Confident	136 Å²	136	73.5 Å²	73.5	59%	0.591	38%	0.378	S	S	*	.	H	α-helix	trans	-63.6	-40	172.1	-71.8	168.3	-172.4	175.2	0	110.9	G109 E110 R117	G109-K113 WeakPolarHBondContact O-CD 3.07Å; G109-K113 VanDerWaalsContact O-CG 3.26Å; G109-K113 WeakPolarHBondContact O-CG 3.48Å; G109-K113 PolarHBondContact O-N 3.17Å; E110-K113 PolarHBondContact O-N 2.98Å; K113-R117 VanDerWaalsContact O-CG 3.24Å; K113-R117 WeakPolarHBondContact O-CG 3.26Å; K113-R117 PolarHBondContact O-N 3Å
114	G	80.9	Confident	82	Confident	28 Å²	28	73.6 Å²	73.6	29%	0.289	37%	0.374	S	S	.	.	H	α-helix	trans	-62.1	-46.5	173.3	0	0	0	0	0	112.4	E110 C111 L112 N116 R117 M118	E110-G114 PolarHBondContact O-N 3.47Å; C111-G114 CarbonylContact O-C 3.57Å; C111-G114 PolarHBondContact O-N 2.91Å; L112-G114 VanDerWaalsContact C-N 3.31Å; G114-N116 PolarHBondContact O-N 3.28Å; G114-R117 WeakPolarHBondContact O-CB 3.48Å; G114-R117 PolarHBondContact O-N 2.88Å; G114-R117 VanDerWaalsContact O-N 3.13Å; G114-M118 PolarHBondContact O-N 3.26Å
115	H	85.2	Confident	81.9	Confident	0 Å²	0	72.1 Å²	72.1	0%	0	37%	0.366	C	S	.	.	H	α-helix	trans	-55.2	-49.9	177.1	-173.8	-84.8	0	0	0	111.5	W86 C100 C103 L107 C111 L112 R117 M118 H124	W86-H115 HydrophobicContact CH2-CB 4.03Å; W86-H115 AromaticContact CH2-CD2 3.68Å; W86-H115 HydrophobicContact CZ3-CB 4.22Å; C100-H115 PolarHBondContact SG-CE1 3.46Å; C103-H115 PolarHBondContact SG-NE2 3.3Å; C103-H115 VanDerWaalsContact SG-NE2 3.41Å; L107-H115 HydrophobicContact CD1-CB 3.79Å; C111-H115 WeakPolarHBondContact O-CB 3.48Å; C111-H115 PolarHBondContact O-N 3.38Å; L112-H115 WeakPolarHBondContact O-CB 3.48Å; L112-H115 PolarHBondContact O-N 3.46Å; H115-R117 VanDerWaalsContact C-N 3.29Å; H115-R117 PolarHBondContact O-N 2.98Å; H115-M118 PolarHBondContact O-N 3.35Å; H115-H124 AromaticContact CE1-CG 3.94Å; H115-H124 AromaticContact CE1-ND1 3.59Å; H115-H124 AromaticContact NE2-ND1 3.78Å
116	N	81.1	Confident	81.5	Confident	63 Å²	63	72.1 Å²	72.1	34%	0.337	37%	0.366	S	S	.	.	H	α-helix	trans	-69.7	-21.7	179.2	-72.6	-5.8	0	0	0	114.5	L112 G114 M118 I126	L112-N116 PolarHBondContact O-N 3.16Å; G114-N116 PolarHBondContact O-N 3.28Å; N116-M118 VanDerWaalsContact C-N 3.34Å; N116-I126 WeakPolarHBondContact OD1-CD1 3.29Å
117	R	83.2	Confident	81	Confident	193 Å²	193	71.4 Å²	71.4	73%	0.728	37%	0.371	S	S	*	.	H	α-helix	trans	-74.7	-26.9	175.8	-77	170.8	-178.7	-174.8	0.8	112.1	K113 G114 H115 P119	K113-R117 VanDerWaalsContact O-CG 3.24Å; K113-R117 WeakPolarHBondContact O-CG 3.26Å; K113-R117 PolarHBondContact O-N 3Å; G114-R117 WeakPolarHBondContact O-CB 3.48Å; G114-R117 PolarHBondContact O-N 2.88Å; G114-R117 VanDerWaalsContact O-N 3.13Å; H115-R117 VanDerWaalsContact C-N 3.29Å; H115-R117 PolarHBondContact O-N 2.98Å; R117-P119 WeakPolarHBondContact O-CD 3.13Å
118	M	80.1	Confident	80.4	Confident	80 Å²	80	75.8 Å²	75.8	39%	0.394	39%	0.394	S	S	.	.	S	Bend	trans	-73.6	118.4	178.7	-69.3	-162.7	-82.4	0	0	110.2	W86 G114 H115 N116 P120 L121 R122	W86-M118 HydrophobicContact CH2-CE 3.57Å; W86-M118 HydrophobicContact CZ2-CE 4.46Å; W86-M118 HydrophobicContact CZ3-CE 4.17Å; G114-M118 PolarHBondContact O-N 3.26Å; H115-M118 PolarHBondContact O-N 3.35Å; N116-M118 VanDerWaalsContact C-N 3.34Å; M118-P120 VanDerWaalsContact C-N 3.31Å; M118-P120 VanDerWaalsContact O-N 3.17Å; M118-L121 HydrophobicContact CB-CD1 4.36Å; M118-L121 HydrophobicContact CB-CG 4.37Å; M118-L121 HydrophobicContact CE-CD1 3.45Å; M118-L121 VanDerWaalsContact CE-CD1 3.45Å; M118-L121 PolarHBondContact O-N 3.22Å; M118-L121 HydrophobicContact SD-CD1 4.45Å; M118-R122 PolarHBondContact O-N 2.95Å
119	P	80.2	Confident	79	Confident	103 Å²	103	78.7 Å²	78.7	67%	0.669	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.5	-37.1	-176.8	-26.5	33.9	0	0	0	115.8	R117 L121	R117-P119 WeakPolarHBondContact O-CD 3.13Å; P119-L121 PolarHBondContact O-N 3.29Å
120	P	82.4	Confident	77	Confident	106 Å²	106	81 Å²	81	69%	0.688	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.5	-33.2	177.3	-21.1	33.3	0	0	0	114	M118	M118-P120 VanDerWaalsContact C-N 3.31Å; M118-P120 VanDerWaalsContact O-N 3.17Å
121	L	81	Confident	75	Confident	34 Å²	34	81.5 Å²	81.5	18%	0.178	42%	0.419	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101	-1.6	-170.4	-48.9	179.3	0	0	0	113.2	W86 M118 P119 N123 H124	W86-L121 HydrophobicContact CH2-CD1 4.45Å; M118-L121 HydrophobicContact CB-CD1 4.36Å; M118-L121 HydrophobicContact CB-CG 4.37Å; M118-L121 HydrophobicContact CE-CD1 3.45Å; M118-L121 VanDerWaalsContact CE-CD1 3.45Å; M118-L121 PolarHBondContact O-N 3.22Å; M118-L121 HydrophobicContact SD-CD1 4.45Å; P119-L121 PolarHBondContact O-N 3.29Å; L121-N123 PolarHBondContact O-N 3.38Å; L121-H124 WeakPolarHBondContact CD2-CE1 3.4Å; L121-H124 WeakPolarHBondContact O-CB 3.49Å; L121-H124 PolarHBondContact O-N 3.17Å
122	R	79.7	Confident	72.8	Confident	148 Å²	148	83.4 Å²	83.4	56%	0.558	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.6	-31.6	-172.9	-176.3	-179.6	-69.2	176.3	1.3	113.4	M118	M118-R122 PolarHBondContact O-N 2.95Å
123	N	76.9	Confident	70.7	Confident	150 Å²	150	90 Å²	90	80%	0.802	46%	0.463	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99	11.8	-176.2	-63.5	-11.3	0	0	0	112.7	L121	L121-N123 PolarHBondContact O-N 3.38Å
124	H	82.3	Confident	68.6	Low	45 Å²	45	90.7 Å²	90.7	21%	0.208	47%	0.468	C	S	.	.			trans	-69.1	143.8	179.8	-72.9	-163.5	0	0	0	111.6	C100 D102 C103 H115 L121 I126	C100-H124 WeakPolarHBondContact SG-CB 3.38Å; C100-H124 PolarHBondContact SG-ND1 3.41Å; C100-H124 VanDerWaalsContact SG-ND1 3.35Å; D102-H124 HydrophobicContact CB-CB 4Å; D102-H124 WeakPolarHBondContact OD2-CA 3.47Å; D102-H124 WeakPolarHBondContact OD2-CB 3.46Å; D102-H124 IonicContact OD2-CD2 3.19Å; D102-H124 IonicContact OD2-CG 2.91Å; C103-H124 PolarHBondContact SG-CE1 3.41Å; C103-H124 PolarHBondContact SG-ND1 2.96Å; H115-H124 AromaticContact CE1-CG 3.94Å; H115-H124 AromaticContact CE1-ND1 3.59Å; H115-H124 AromaticContact NE2-ND1 3.78Å; L121-H124 WeakPolarHBondContact CD2-CE1 3.4Å; L121-H124 WeakPolarHBondContact O-CB 3.49Å; L121-H124 PolarHBondContact O-N 3.17Å; H124-I126 PolarHBondContact O-N 3.35Å; H124-I126 VanDerWaalsContact O-N 3.16Å
125	N	77	Confident	67	Low	89 Å²	89	94.7 Å²	94.7	48%	0.476	48%	0.483	S	S	.	.			trans	-71.3	109.1	173.5	-165.4	27.1	0	0	0	109.1	E101 D102	E101-N125 HydrophobicContact CB-CB 4.48Å; E101-N125 PolarHBondContact N-O 3.43Å; E101-N125 PolarHBondContact OE2-ND2 3.15Å; D102-N125 PolarHBondContact OD2-N 2.71Å
126	I	77.2	Confident	65.3	Low	28 Å²	28	97.8 Å²	97.8	14%	0.144	51%	0.514	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	108.5	179.2	-63.7	156.9	0	0	0	107.5	H99 C100 L112 N116 H124 L128	H99-I126 CarbonylContact O-C 3.54Å; H99-I126 WeakPolarHBondContact O-CA 3.49Å; C100-I126 HydrophobicContact CB-CG1 4.31Å; L112-I126 HydrophobicContact CD1-CD1 3.79Å; L112-I126 HydrophobicContact CD1-CG1 4.2Å; L112-I126 HydrophobicContact CD1-CG2 3.7Å; L112-I126 HydrophobicContact CD2-CG2 4.19Å; N116-I126 WeakPolarHBondContact OD1-CD1 3.29Å; H124-I126 PolarHBondContact O-N 3.35Å; H124-I126 VanDerWaalsContact O-N 3.16Å; I126-L128 VanDerWaalsContact C-N 3.26Å; I126-L128 HydrophobicContact CB-CD1 4.44Å; I126-L128 HydrophobicContact CG2-CD1 3.73Å; I126-L128 HydrophobicContact CG2-CG 4.37Å; I126-L128 PolarHBondContact O-N 3.21Å
127	T	74.5	Confident	64.3	Low	63 Å²	63	97 Å²	97	39%	0.387	51%	0.514	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	88.6	163.7	-52.1	0	0	0	0	106.3	G98 H99 E101 L129	G98-T127 WeakPolarHBondContact CA-O 3.4Å; H99-T127 PolarHBondContact N-O 3.03Å; H99-T127 PolarHBondContact O-N 3.25Å; E101-T127 VanDerWaalsContact CD-OG1 3.31Å; E101-T127 PolarHBondContact OE1-OG1 2.85Å; T127-L129 PolarHBondContact O-N 2.85Å
128	L	68.9	Low	64	Low	92 Å²	92	90.1 Å²	90.1	48%	0.482	49%	0.491	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-52.9	132.3	164.5	-86.9	87.4	0	0	0	105.7	L112 I126 S130	L112-L128 HydrophobicContact CD2-CD1 4.45Å; L112-L128 HydrophobicContact CD2-CG 4.32Å; I126-L128 VanDerWaalsContact C-N 3.26Å; I126-L128 HydrophobicContact CB-CD1 4.44Å; I126-L128 HydrophobicContact CG2-CD1 3.73Å; I126-L128 HydrophobicContact CG2-CG 4.37Å; I126-L128 PolarHBondContact O-N 3.21Å; L128-S130 PolarHBondContact O-N 3.45Å
129	L	55.8	Low	63.9	Low	69 Å²	69	90.9 Å²	90.9	36%	0.361	49%	0.49	S	S	.	.			trans	-55.1	111	145.9	-99.1	71.7	0	0	0	100.7	T97 W106 T127 K131	T97-L129 PolarHBondContact O-N 3.4Å; T97-L129 VanDerWaalsContact O-O 3.13Å; W106-L129 HydrophobicContact CE3-CD1 4.19Å; W106-L129 HydrophobicContact CH2-CD1 4.23Å; W106-L129 HydrophobicContact CZ3-CD1 3.36Å; T127-L129 PolarHBondContact O-N 2.85Å; L129-K131 PolarHBondContact O-N 3.39Å
130	S	39.2	Very low	64	Low	78 Å²	78	86.6 Å²	86.6	55%	0.545	46%	0.462	S	S	.	.			trans	-40	125.5	163.7	40.9	0	0	0	0	103.3	L128 S132	L128-S130 PolarHBondContact O-N 3.45Å; S130-S132 PolarHBondContact O-N 3.23Å; S130-S132 PolarHBondContact O-OG 3.44Å; S130-S132 PolarHBondContact OG-OG 3.47Å
131	K	38.2	Very low	64	Low	168 Å²	168	91.2 Å²	91.2	73%	0.73	47%	0.474	S	S	*	.			trans	-59.4	74.1	158.7	-68.7	174	177.4	177.4	0	102.7	L129 E133	L129-K131 PolarHBondContact O-N 3.39Å; K131-E133 VanDerWaalsContact C-N 3.26Å; K131-E133 VanDerWaalsContact O-CA 3.24Å; K131-E133 WeakPolarHBondContact O-CA 3.39Å; K131-E133 VanDerWaalsContact O-CG 3.31Å; K131-E133 WeakPolarHBondContact O-CG 3.4Å; K131-E133 PolarHBondContact O-N 3.37Å
132	S	38.8	Very low	64.1	Low	63 Å²	63	93 Å²	93	44%	0.441	49%	0.494	S	S	.	.			trans	-62.3	104.9	-167.1	-74.5	0	0	0	0	102.3	S130 H134 L135	S130-S132 PolarHBondContact O-N 3.23Å; S130-S132 PolarHBondContact O-OG 3.44Å; S130-S132 PolarHBondContact OG-OG 3.47Å; S132-H134 PolarHBondContact O-N 2.95Å; S132-L135 PolarHBondContact O-N 2.97Å
133	E	39	Very low	64.2	Low	153 Å²	153	89 Å²	89	72%	0.715	48%	0.481	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	102.9	-154.6	-71.9	159.6	151	0	0	107.2	K131 L135 R139	K131-E133 VanDerWaalsContact C-N 3.26Å; K131-E133 VanDerWaalsContact O-CA 3.24Å; K131-E133 WeakPolarHBondContact O-CA 3.39Å; K131-E133 VanDerWaalsContact O-CG 3.31Å; K131-E133 WeakPolarHBondContact O-CG 3.4Å; K131-E133 PolarHBondContact O-N 3.37Å; E133-L135 VanDerWaalsContact C-N 3.33Å; E133-L135 PolarHBondContact O-N 3.1Å; E133-R139 PolarHBondContact O-NH2 3.22Å
134	H	40	Very low	64.3	Low	152 Å²	152	85.8 Å²	85.8	70%	0.704	47%	0.469	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.6	48.4	171.7	-56.1	-85.1	0	0	0	113.6	S132 G136 S137	S132-H134 PolarHBondContact O-N 2.95Å; H134-G136 PolarHBondContact O-N 3.48Å; H134-S137 PolarHBondContact O-N 2.83Å
135	L	45.7	Very low	64.1	Low	112 Å²	112	90.3 Å²	90.3	59%	0.586	49%	0.494	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.4	-2.7	175.2	-140.7	90.2	0	0	0	114.3	N71 S132 E133	N71-L135 PolarHBondContact OD1-O 3.31Å; S132-L135 PolarHBondContact O-N 2.97Å; E133-L135 VanDerWaalsContact C-N 3.33Å; E133-L135 PolarHBondContact O-N 3.1Å
136	G	51	Low	64.3	Low	64 Å²	64	89.8 Å²	89.8	66%	0.66	49%	0.489	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102	-0.4	-177.1	0	0	0	0	0	115.5	N71 H134	N71-G136 PolarHBondContact ND2-O 3.33Å; N71-G136 VanDerWaalsContact ND2-O 3.11Å; H134-G136 PolarHBondContact O-N 3.48Å
137	S	60.3	Low	64.7	Low	47 Å²	47	89.5 Å²	89.5	33%	0.329	49%	0.491	S	S	.	.	S	Bend	trans	-117.5	134	177.8	-162.1	0	0	0	0	111.1	H134 R139 A147	H134-S137 PolarHBondContact O-N 2.83Å; S137-R139 PolarHBondContact O-N 3.48Å; S137-A147 WeakPolarHBondContact OG-CB 3.32Å
138	L	75.5	Confident	65.2	Low	48 Å²	48	88 Å²	88	25%	0.251	48%	0.48	S	S	.	.	P	Polyproline II helix	trans	-61	132	172.9	-63.1	172.2	0	0	0	108.2	N71 L148 L158	N71-L138 PolarHBondContact ND2-N 2.69Å; L138-L148 HydrophobicContact CB-CB 4.24Å; L138-L148 HydrophobicContact CB-CD1 3.69Å; L138-L148 HydrophobicContact CB-CG 4.18Å; L138-L148 WeakPolarHBondContact O-CB 3.14Å; L138-L148 WeakPolarHBondContact O-CG 3.4Å; L138-L148 PolarHBondContact O-N 2.7Å; L138-L158 HydrophobicContact CD1-CD1 3.79Å
139	R	77.9	Confident	66.1	Low	97 Å²	97	87.6 Å²	87.6	37%	0.366	48%	0.476	S	S	.	.	B	Isolated β-bridge	trans	-100.4	149.9	-178.2	-71.5	171	171.1	-70	-0.7	110.5	E133 S137 P144 N145 E146	E133-R139 PolarHBondContact O-NH2 3.22Å; S137-R139 PolarHBondContact O-N 3.48Å; R139-P144 WeakPolarHBondContact CD-O 3.36Å; R139-P144 WeakPolarHBondContact CG-O 3.38Å; R139-P144 PolarHBondContact NH1-O 3.43Å; R139-N145 PolarHBondContact NH1-O 3.12Å; R139-E146 WeakPolarHBondContact CA-O 3.49Å
140	C	83.1	Confident	67.6	Low	12 Å²	12	84.5 Å²	84.5	8%	0.081	46%	0.46	C	S	.	.	P	Polyproline II helix	trans	-73.1	134.5	176.9	180	0	0	0	0	111.2	A142 H143 P144 E146 L148 C160 C163	C140-A142 VanDerWaalsContact C-N 3.29Å; C140-A142 PolarHBondContact O-N 3.2Å; C140-A142 PolarHBondContact SG-N 3.26Å; C140-A142 VanDerWaalsContact SG-N 3.44Å; C140-H143 HydrophobicContact CB-CB 4.05Å; C140-H143 WeakPolarHBondContact CB-O 3.46Å; C140-H143 CarbonylContact O-C 3.47Å; C140-H143 PolarHBondContact O-N 3.16Å; C140-P144 WeakPolarHBondContact O-CA 3.48Å; C140-E146 PolarHBondContact N-O 3.22Å; C140-L148 HydrophobicContact CB-CD2 3.77Å; C140-C160 HydrophobicContact CB-CB 3.81Å; C140-C163 PolarHBondContact SG-SG 3.05Å
141	E	82.2	Confident	70.1	Confident	203 Å²	203	82.3 Å²	82.3	95%	0.949	44%	0.441	S	S	*	.	S	Bend	trans	-62	-35.8	176.2	-64.7	-179.8	179.7	0	0	112.6
142	A	82.4	Confident	72.6	Confident	73 Å²	73	74.3 Å²	74.3	60%	0.603	41%	0.406	S	S	*	.	S	Bend	trans	-80.6	-28.7	176.5	0	0	0	0	0	113	C140	C140-A142 VanDerWaalsContact C-N 3.29Å; C140-A142 PolarHBondContact O-N 3.2Å; C140-A142 PolarHBondContact SG-N 3.26Å; C140-A142 VanDerWaalsContact SG-N 3.44Å
143	H	82.2	Confident	75	Confident	62 Å²	62	74.4 Å²	74.4	29%	0.287	40%	0.4	S	S	.	.			trans	-129.9	81.1	-177.1	-53.2	104.7	0	0	0	109.5	C140 N145 E146 C160 C163	C140-H143 HydrophobicContact CB-CB 4.05Å; C140-H143 WeakPolarHBondContact CB-O 3.46Å; C140-H143 CarbonylContact O-C 3.47Å; C140-H143 PolarHBondContact O-N 3.16Å; H143-N145 PolarHBondContact O-N 3.14Å; H143-N145 VanDerWaalsContact O-N 3.09Å; H143-E146 HydrophobicContact CB-CB 3.87Å; H143-E146 HydrophobicContact CB-CG 3.89Å; H143-E146 PolarHBondContact O-N 2.97Å; H143-C160 PolarHBondContact ND1-SG 3.19Å; H143-C163 PolarHBondContact CE1-SG 3.45Å; H143-C163 PolarHBondContact ND1-SG 3.04Å
144	P	78.2	Confident	77.2	Confident	83 Å²	83	70.3 Å²	70.3	54%	0.539	39%	0.392	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.1	-23.9	-170	21.9	-32.6	0	0	0	113.5	R139 C140 E146	R139-P144 WeakPolarHBondContact CD-O 3.36Å; R139-P144 WeakPolarHBondContact CG-O 3.38Å; R139-P144 PolarHBondContact NH1-O 3.43Å; C140-P144 WeakPolarHBondContact O-CA 3.48Å; P144-E146 VanDerWaalsContact C-N 3.35Å
145	N	79.3	Confident	79.5	Confident	140 Å²	140	65.7 Å²	65.7	75%	0.749	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.5	-17.2	176.8	-67.3	-20.3	0	0	0	113.4	R139 H143	R139-N145 PolarHBondContact NH1-O 3.12Å; H143-N145 PolarHBondContact O-N 3.14Å; H143-N145 VanDerWaalsContact O-N 3.09Å
146	E	81.6	Confident	81.5	Confident	78 Å²	78	62.8 Å²	62.8	36%	0.364	37%	0.373	S	S	.	.	S	Bend	trans	-95.6	135.9	-175.1	-66.6	-62.5	137.1	0	0	112.1	R139 C140 H143 P144 C160	R139-E146 WeakPolarHBondContact CA-O 3.49Å; C140-E146 PolarHBondContact N-O 3.22Å; H143-E146 HydrophobicContact CB-CB 3.87Å; H143-E146 HydrophobicContact CB-CG 3.89Å; H143-E146 PolarHBondContact O-N 2.97Å; P144-E146 VanDerWaalsContact C-N 3.35Å; E146-C160 HydrophobicContact CB-CB 3.67Å
147	A	84	Confident	83.2	Confident	22 Å²	22	62.8 Å²	62.8	18%	0.182	36%	0.36	C	S	.	.	B	Isolated β-bridge	trans	-77.5	147.1	174.3	0	0	0	0	0	111.6	S137 E149 C160	S137-A147 WeakPolarHBondContact OG-CB 3.32Å; A147-E149 VanDerWaalsContact C-N 3.33Å; A147-E149 HydrophobicContact CB-CG 4Å; A147-E149 PolarHBondContact O-N 3.09Å; A147-C160 WeakPolarHBondContact O-CA 3.36Å; A147-C160 WeakPolarHBondContact O-CB 3.46Å
148	L	86.6	Confident	84.6	Confident	31 Å²	31	64 Å²	64	16%	0.162	36%	0.363	C	S	.	.			trans	-76.7	82.5	171.6	-64.2	-177.4	0	0	0	110.2	L138 C140 L158 C160	L138-L148 HydrophobicContact CB-CB 4.24Å; L138-L148 HydrophobicContact CB-CD1 3.69Å; L138-L148 HydrophobicContact CB-CG 4.18Å; L138-L148 WeakPolarHBondContact O-CB 3.14Å; L138-L148 WeakPolarHBondContact O-CG 3.4Å; L138-L148 PolarHBondContact O-N 2.7Å; C140-L148 HydrophobicContact CB-CD2 3.77Å; L148-L158 HydrophobicContact CB-CB 4.14Å; L148-L158 HydrophobicContact CD1-CB 3.84Å; L148-L158 HydrophobicContact CD1-CD1 4.39Å; L148-L158 HydrophobicContact CG-CB 4.42Å; L148-C160 HydrophobicContact CD2-CB 4.47Å
149	E	86.4	Confident	85.2	Confident	84 Å²	84	62 Å²	62	39%	0.393	35%	0.352	S	S	.	.			trans	-96.1	-14.4	-178.6	-62.2	-173.3	158	0	0	114.1	A147 T159 R161 W176 V177	A147-E149 VanDerWaalsContact C-N 3.33Å; A147-E149 HydrophobicContact CB-CG 4Å; A147-E149 PolarHBondContact O-N 3.09Å; E149-T159 PolarHBondContact N-O 3.31Å; E149-R161 IonicContact OE2-NH2 3.87Å; E149-R161 PolarHBondContact OE2-NH2 2.95Å; E149-W176 HydrophobicContact CB-CE3 4.18Å; E149-W176 HydrophobicContact CB-CZ3 4.02Å; E149-V177 VanDerWaalsContact C-CG2 3.43Å; E149-V177 WeakPolarHBondContact O-CG2 3.15Å; E149-V177 PolarHBondContact O-N 3.19Å
150	C	88.4	Confident	85.8	Confident	4 Å²	4	57.3 Å²	57.3	3%	0.027	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	152.3	-177	-59.4	0	0	0	0	111.4	L158 T159 Q164 R175 V177	C150-L158 CarbonylContact O-C 3.52Å; C150-L158 WeakPolarHBondContact O-CA 3.45Å; C150-T159 WeakPolarHBondContact CA-O 3.21Å; C150-T159 WeakPolarHBondContact CB-O 3.35Å; C150-T159 VanDerWaalsContact CB-OG1 3.29Å; C150-T159 WeakPolarHBondContact CB-OG1 3.31Å; C150-T159 PolarHBondContact N-O 3.41Å; C150-T159 PolarHBondContact O-N 3.12Å; C150-T159 VanDerWaalsContact O-O 3.11Å; C150-Q164 HydrophobicContact CB-CB 4.3Å; C150-Q164 HydrophobicContact CB-CG 4.36Å; C150-R175 CarbonylContact C-O 3.36Å; C150-R175 WeakPolarHBondContact CA-O 3.25Å; C150-V177 WeakPolarHBondContact O-CG2 3.42Å
151	F	90.3	Very high	86.1	Confident	33 Å²	33	62.6 Å²	62.6	15%	0.145	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	121	172.2	176.1	-98.7	0	0	0	108.6	E153 L158 H174 R175 V177 K180	F151-E153 HydrophobicContact CD1-CG 3.93Å; F151-E153 HydrophobicContact CE1-CB 4.29Å; F151-E153 HydrophobicContact CE1-CG 3.96Å; F151-L158 HydrophobicContact CB-CD2 4.49Å; F151-L158 HydrophobicContact CD2-CD2 4.19Å; F151-H174 WeakPolarHBondContact O-CA 3.37Å; F151-R175 PolarHBondContact N-O 3.14Å; F151-R175 PolarHBondContact O-N 3.37Å; F151-V177 HydrophobicContact CB-CG2 4.39Å; F151-K180 HydrophobicContact CB-CB 4.48Å; F151-K180 HydrophobicContact CD1-CB 4.48Å; F151-K180 HydrophobicContact CD1-CD 3.97Å; F151-K180 HydrophobicContact CD1-CG 3.8Å; F151-K180 HydrophobicContact CE1-CD 4.05Å; F151-K180 VanDerWaalsContact CE1-CE 3.5Å; F151-K180 HydrophobicContact CE1-CG 4.14Å; F151-K180 HydrophobicContact CG-CG 4.09Å
152	C	91.1	Very high	86.4	Confident	0 Å²	0	56.2 Å²	56.2	0%	0	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	111.9	175.9	-179.4	0	0	0	0	109.3	A154 C155 G156 V157 T159 H168 H171	C152-A154 VanDerWaalsContact C-N 3.33Å; C152-A154 PolarHBondContact O-N 2.81Å; C152-C155 HydrophobicContact CB-CB 4.24Å; C152-C155 PolarHBondContact O-N 2.96Å; C152-G156 PolarHBondContact O-N 2.82Å; C152-V157 PolarHBondContact N-O 3.29Å; C152-T159 HydrophobicContact CB-CG2 4.23Å; C152-H168 HydrophobicContact CB-CB 4.46Å; C152-H171 PolarHBondContact SG-ND1 3.38Å
153	E	88.8	Confident	86.7	Confident	65 Å²	65	53.5 Å²	53.5	30%	0.304	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.8	-29.8	-174.3	-55.7	-159.3	113.7	0	0	112.8	F151 S173 R175 K180	F151-E153 HydrophobicContact CD1-CG 3.93Å; F151-E153 HydrophobicContact CE1-CB 4.29Å; F151-E153 HydrophobicContact CE1-CG 3.96Å; E153-S173 PolarHBondContact N-O 3.26Å; E153-S173 VanDerWaalsContact N-O 3.11Å; E153-R175 VanDerWaalsContact CD-NE 3.25Å; E153-R175 HydrophobicContact CG-CG 4.28Å; E153-R175 VanDerWaalsContact OE1-CD 3.29Å; E153-R175 WeakPolarHBondContact OE1-CD 3.26Å; E153-R175 IonicContact OE1-NE 3.21Å; E153-R175 PolarHBondContact OE1-NE 3.37Å; E153-R175 IonicContact OE2-CZ 3.26Å; E153-R175 IonicContact OE2-NE 2.7Å; E153-R175 PolarHBondContact OE2-NE 2.89Å; E153-R175 IonicContact OE2-NH2 2.68Å; E153-K180 IonicContact OE1-NZ 3.34Å; E153-K180 PolarHBondContact OE1-NZ 3.19Å
154	A	86.3	Confident	87	Confident	67 Å²	67	51.1 Å²	51.1	55%	0.554	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.1	-33.8	176.6	0	0	0	0	0	112.9	C152 H171	C152-A154 VanDerWaalsContact C-N 3.33Å; C152-A154 PolarHBondContact O-N 2.81Å; A154-H171 HydrophobicContact CB-CB 3.81Å
155	C	88.5	Confident	87.4	Confident	55 Å²	55	52.8 Å²	52.8	37%	0.372	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.7	-20.7	-177.5	-64.3	0	0	0	0	113.8	C152 V157 H168 H171	C152-C155 HydrophobicContact CB-CB 4.24Å; C152-C155 PolarHBondContact O-N 2.96Å; C155-V157 VanDerWaalsContact C-N 3.3Å; C155-V157 HydrophobicContact CB-CG2 3.78Å; C155-V157 PolarHBondContact O-N 3.12Å; C155-H168 PolarHBondContact SG-ND1 3.38Å; C155-H171 PolarHBondContact SG-CE1 2.81Å; C155-H171 PolarHBondContact SG-ND1 2.68Å
156	G	86.8	Confident	87.8	Confident	50 Å²	50	49.3 Å²	49.3	52%	0.515	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	70.1	22.3	-175.2	0	0	0	0	0	114.4	C152	C152-G156 PolarHBondContact O-N 2.82Å
157	V	87.6	Confident	88	Confident	65 Å²	65	50.8 Å²	50.8	39%	0.394	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	151.4	-176.8	-58.2	0	0	0	0	112.2	C152 C155 T159	C152-V157 PolarHBondContact N-O 3.29Å; C155-V157 VanDerWaalsContact C-N 3.3Å; C155-V157 HydrophobicContact CB-CG2 3.78Å; C155-V157 PolarHBondContact O-N 3.12Å; V157-T159 HydrophobicContact CG2-CG2 4.11Å
158	L	89.3	Confident	88	Confident	73 Å²	73	51.1 Å²	51.1	38%	0.382	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	134.6	170.8	-65.1	172.3	0	0	0	109.8	L138 L148 C150 F151 V177	L138-L158 HydrophobicContact CD1-CD1 3.79Å; L148-L158 HydrophobicContact CB-CB 4.14Å; L148-L158 HydrophobicContact CD1-CB 3.84Å; L148-L158 HydrophobicContact CD1-CD1 4.39Å; L148-L158 HydrophobicContact CG-CB 4.42Å; C150-L158 CarbonylContact O-C 3.52Å; C150-L158 WeakPolarHBondContact O-CA 3.45Å; F151-L158 HydrophobicContact CB-CD2 4.49Å; F151-L158 HydrophobicContact CD2-CD2 4.19Å; L158-V177 HydrophobicContact CD2-CG1 4.28Å; L158-V177 HydrophobicContact CD2-CG2 3.48Å; L158-V177 VanDerWaalsContact CD2-CG2 3.48Å
159	T	87.8	Confident	87.9	Confident	4 Å²	4	58.5 Å²	58.5	3%	0.025	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	147.2	-178.2	56.8	0	0	0	0	110	E149 C150 C152 V157 Q164	E149-T159 PolarHBondContact N-O 3.31Å; C150-T159 WeakPolarHBondContact CA-O 3.21Å; C150-T159 WeakPolarHBondContact CB-O 3.35Å; C150-T159 VanDerWaalsContact CB-OG1 3.29Å; C150-T159 WeakPolarHBondContact CB-OG1 3.31Å; C150-T159 PolarHBondContact N-O 3.41Å; C150-T159 PolarHBondContact O-N 3.12Å; C150-T159 VanDerWaalsContact O-O 3.11Å; C152-T159 HydrophobicContact CB-CG2 4.23Å; V157-T159 HydrophobicContact CG2-CG2 4.11Å; T159-Q164 PolarHBondContact OG1-OE1 2.85Å
160	C	91.1	Very high	87.9	Confident	0 Å²	0	61.7 Å²	61.7	0%	0	34%	0.338	C	S	.	.			trans	-77.6	169.2	161.2	69.7	0	0	0	0	109.7	C140 H143 E146 A147 L148 D162 C163 Q164	C140-C160 HydrophobicContact CB-CB 3.81Å; H143-C160 PolarHBondContact ND1-SG 3.19Å; E146-C160 HydrophobicContact CB-CB 3.67Å; A147-C160 WeakPolarHBondContact O-CA 3.36Å; A147-C160 WeakPolarHBondContact O-CB 3.46Å; L148-C160 HydrophobicContact CD2-CB 4.47Å; C160-D162 VanDerWaalsContact C-N 3.25Å; C160-D162 PolarHBondContact O-N 3.39Å; C160-C163 PolarHBondContact O-N 3.13Å; C160-C163 PolarHBondContact SG-N 3.04Å; C160-C163 VanDerWaalsContact SG-N 3.35Å; C160-Q164 WeakPolarHBondContact O-CB 3.44Å; C160-Q164 PolarHBondContact O-N 3.24Å
161	R	88.6	Confident	87.8	Confident	122 Å²	122	65.1 Å²	65.1	46%	0.46	35%	0.354	S	S	.	.	H	α-helix	trans	-55.1	-41.5	178.5	-167.3	174.3	-60.8	-175.2	7.2	112.4	E149 Q164 L165	E149-R161 IonicContact OE2-NH2 3.87Å; E149-R161 PolarHBondContact OE2-NH2 2.95Å; R161-Q164 PolarHBondContact O-N 2.97Å; R161-L165 HydrophobicContact CG-CD1 4.11Å; R161-L165 VanDerWaalsContact O-CG 3.27Å; R161-L165 WeakPolarHBondContact O-CG 3.33Å; R161-L165 PolarHBondContact O-N 3.43Å; R161-L165 VanDerWaalsContact O-N 3.09Å
162	D	88.9	Confident	87.1	Confident	69 Å²	69	66.8 Å²	66.8	37%	0.369	38%	0.38	S	S	.	.	H	α-helix	trans	-70.8	-42.3	-178.5	-62	-32.9	0	0	0	112.9	C160 Q164 L165 S166	C160-D162 VanDerWaalsContact C-N 3.25Å; C160-D162 PolarHBondContact O-N 3.39Å; D162-Q164 VanDerWaalsContact C-N 3.29Å; D162-Q164 PolarHBondContact O-N 3.1Å; D162-L165 PolarHBondContact O-N 2.99Å; D162-S166 WeakPolarHBondContact O-CB 3.36Å; D162-S166 PolarHBondContact O-N 3.38Å; D162-S166 PolarHBondContact O-OG 2.93Å
163	C	89.2	Confident	86.7	Confident	16 Å²	16	68.9 Å²	68.9	11%	0.108	40%	0.395	C	S	.	.	H	α-helix	trans	-62.1	-38.4	172.9	-78.1	0	0	0	0	111.8	C140 H143 C160 L165 S166 V167 H168	C140-C163 PolarHBondContact SG-SG 3.05Å; H143-C163 PolarHBondContact CE1-SG 3.45Å; H143-C163 PolarHBondContact ND1-SG 3.04Å; C160-C163 PolarHBondContact O-N 3.13Å; C160-C163 PolarHBondContact SG-N 3.04Å; C160-C163 VanDerWaalsContact SG-N 3.35Å; C163-L165 VanDerWaalsContact C-N 3.32Å; C163-L165 PolarHBondContact O-N 2.85Å; C163-S166 WeakPolarHBondContact CA-OG 3.45Å; C163-S166 PolarHBondContact O-N 3.02Å; C163-S166 PolarHBondContact O-OG 3.02Å; C163-V167 PolarHBondContact O-N 3.44Å; C163-V167 VanDerWaalsContact O-N 3.16Å; C163-H168 PolarHBondContact O-N 3.16Å; C163-H168 VanDerWaalsContact O-N 3.13Å
164	Q	87.6	Confident	86.6	Confident	13 Å²	13	70.6 Å²	70.6	6%	0.061	40%	0.403	C	S	.	.	H	α-helix	trans	-65.5	-36.8	178.6	-170.5	55.9	44.5	0	0	112.3	C150 T159 C160 R161 D162 H168 R169 H174	C150-Q164 HydrophobicContact CB-CB 4.3Å; C150-Q164 HydrophobicContact CB-CG 4.36Å; T159-Q164 PolarHBondContact OG1-OE1 2.85Å; C160-Q164 WeakPolarHBondContact O-CB 3.44Å; C160-Q164 PolarHBondContact O-N 3.24Å; R161-Q164 PolarHBondContact O-N 2.97Å; D162-Q164 VanDerWaalsContact C-N 3.29Å; D162-Q164 PolarHBondContact O-N 3.1Å; Q164-H168 PolarHBondContact NE2-O 3.4Å; Q164-H168 CarbonylContact O-C 3.58Å; Q164-H168 VanDerWaalsContact O-C 3.3Å; Q164-R169 WeakPolarHBondContact O-CA 3.48Å; Q164-R169 PolarHBondContact O-N 2.78Å; Q164-H174 HydrophobicContact CG-CB 3.93Å
165	L	86.8	Confident	86.7	Confident	117 Å²	117	70.9 Å²	70.9	61%	0.613	39%	0.389	S	S	*	.	H	α-helix	trans	-84.9	-15.6	-179.4	-66.9	173.3	0	0	0	114	R161 D162 C163	R161-L165 HydrophobicContact CG-CD1 4.11Å; R161-L165 VanDerWaalsContact O-CG 3.27Å; R161-L165 WeakPolarHBondContact O-CG 3.33Å; R161-L165 PolarHBondContact O-N 3.43Å; R161-L165 VanDerWaalsContact O-N 3.09Å; D162-L165 PolarHBondContact O-N 2.99Å; C163-L165 VanDerWaalsContact C-N 3.32Å; C163-L165 PolarHBondContact O-N 2.85Å
166	S	88.8	Confident	86.7	Confident	68 Å²	68	74.1 Å²	74.1	48%	0.476	39%	0.394	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.2	-87.1	178.2	55.2	0	0	0	0	111	D162 C163 H168 R169	D162-S166 WeakPolarHBondContact O-CB 3.36Å; D162-S166 PolarHBondContact O-N 3.38Å; D162-S166 PolarHBondContact O-OG 2.93Å; C163-S166 WeakPolarHBondContact CA-OG 3.45Å; C163-S166 PolarHBondContact O-N 3.02Å; C163-S166 PolarHBondContact O-OG 3.02Å; S166-H168 PolarHBondContact O-N 3.3Å; S166-R169 WeakPolarHBondContact O-CB 3.33Å; S166-R169 PolarHBondContact O-N 3.01Å
167	V	85.9	Confident	86.8	Confident	108 Å²	108	73.9 Å²	73.9	66%	0.655	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.3	-36.5	-172	-177.2	0	0	0	0	112.3	C163	C163-V167 PolarHBondContact O-N 3.44Å; C163-V167 VanDerWaalsContact O-N 3.16Å
168	H	84.3	Confident	86.6	Confident	30 Å²	30	73.1 Å²	73.1	14%	0.139	39%	0.388	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.1	15.8	-176.7	-59	-96	0	0	0	113.8	C152 C155 C163 Q164 S166 D170 H171	C152-H168 HydrophobicContact CB-CB 4.46Å; C155-H168 PolarHBondContact SG-ND1 3.38Å; C163-H168 PolarHBondContact O-N 3.16Å; C163-H168 VanDerWaalsContact O-N 3.13Å; Q164-H168 PolarHBondContact NE2-O 3.4Å; Q164-H168 CarbonylContact O-C 3.58Å; Q164-H168 VanDerWaalsContact O-C 3.3Å; S166-H168 PolarHBondContact O-N 3.3Å; H168-D170 VanDerWaalsContact C-N 3.35Å; H168-D170 PolarHBondContact O-N 3.48Å; H168-H171 WeakPolarHBondContact CA-ND1 3.48Å; H168-H171 WeakPolarHBondContact CB-ND1 3.33Å; H168-H171 AromaticContact CG-ND1 3.66Å; H168-H171 AromaticContact ND1-CE1 3.42Å; H168-H171 PolarHBondContact ND1-CE1 2.92Å; H168-H171 AromaticContact ND1-ND1 3.2Å; H168-H171 PolarHBondContact ND1-ND1 3.17Å; H168-H171 PolarHBondContact O-N 3.03Å
169	R	84	Confident	86.6	Confident	185 Å²	185	73.6 Å²	73.6	70%	0.698	39%	0.388	S	S	*	.	G	3₁₀ helix	trans	-59.4	-44.2	-176.1	-175.7	179.6	175.4	-177.2	-2	112.6	Q164 S166 H171	Q164-R169 WeakPolarHBondContact O-CA 3.48Å; Q164-R169 PolarHBondContact O-N 2.78Å; S166-R169 WeakPolarHBondContact O-CB 3.33Å; S166-R169 PolarHBondContact O-N 3.01Å; R169-H171 VanDerWaalsContact C-N 3.28Å; R169-H171 PolarHBondContact O-N 3.02Å
170	D	86.7	Confident	86.5	Confident	152 Å²	152	75.1 Å²	75.1	81%	0.813	39%	0.394	S	S	*	.	G	3₁₀ helix	trans	-84	-0.9	-173.1	-60.2	-33.3	0	0	0	113.4	H168 G172	H168-D170 VanDerWaalsContact C-N 3.35Å; H168-D170 PolarHBondContact O-N 3.48Å; D170-G172 VanDerWaalsContact C-N 3.28Å; D170-G172 PolarHBondContact O-N 3.33Å
171	H	86.6	Confident	86.4	Confident	76 Å²	76	77.7 Å²	77.7	35%	0.352	42%	0.415	S	S	.	.	G	3₁₀ helix	trans	-78	-13.6	177	-63	154	0	0	0	113.4	C152 A154 C155 H168 R169 S173	C152-H171 PolarHBondContact SG-ND1 3.38Å; A154-H171 HydrophobicContact CB-CB 3.81Å; C155-H171 PolarHBondContact SG-CE1 2.81Å; C155-H171 PolarHBondContact SG-ND1 2.68Å; H168-H171 WeakPolarHBondContact CA-ND1 3.48Å; H168-H171 WeakPolarHBondContact CB-ND1 3.33Å; H168-H171 AromaticContact CG-ND1 3.66Å; H168-H171 AromaticContact ND1-CE1 3.42Å; H168-H171 PolarHBondContact ND1-CE1 2.92Å; H168-H171 AromaticContact ND1-ND1 3.2Å; H168-H171 PolarHBondContact ND1-ND1 3.17Å; H168-H171 PolarHBondContact O-N 3.03Å; R169-H171 VanDerWaalsContact C-N 3.28Å; R169-H171 PolarHBondContact O-N 3.02Å; H171-S173 PolarHBondContact O-N 3.15Å
172	G	74.2	Confident	86.5	Confident	68 Å²	68	77.9 Å²	77.9	70%	0.701	42%	0.424	S	S	*	.			trans	73	-38.1	168.8	0	0	0	0	0	116.2	D170	D170-G172 VanDerWaalsContact C-N 3.28Å; D170-G172 PolarHBondContact O-N 3.33Å
173	S	82.7	Confident	86.4	Confident	43 Å²	43	78.4 Å²	78.4	30%	0.301	42%	0.424	S	S	.	.			trans	-105.6	113.4	-178.2	54.7	0	0	0	0	111.9	E153 H171	E153-S173 PolarHBondContact N-O 3.26Å; E153-S173 VanDerWaalsContact N-O 3.11Å; H171-S173 PolarHBondContact O-N 3.15Å
174	H	86.9	Confident	86.4	Confident	101 Å²	101	82 Å²	82	47%	0.468	44%	0.442	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	149.6	168.6	69.4	-79.5	0	0	0	109.6	F151 Q164	F151-H174 WeakPolarHBondContact O-CA 3.37Å; Q164-H174 HydrophobicContact CG-CB 3.93Å
175	R	88.9	Confident	86.6	Confident	74 Å²	74	87 Å²	87	28%	0.279	46%	0.464	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	153.3	170.6	-67.2	-169.3	-173.7	-91.6	-8.8	109.9	C150 F151 E153 E179	C150-R175 CarbonylContact C-O 3.36Å; C150-R175 WeakPolarHBondContact CA-O 3.25Å; F151-R175 PolarHBondContact N-O 3.14Å; F151-R175 PolarHBondContact O-N 3.37Å; E153-R175 VanDerWaalsContact CD-NE 3.25Å; E153-R175 HydrophobicContact CG-CG 4.28Å; E153-R175 VanDerWaalsContact OE1-CD 3.29Å; E153-R175 WeakPolarHBondContact OE1-CD 3.26Å; E153-R175 IonicContact OE1-NE 3.21Å; E153-R175 PolarHBondContact OE1-NE 3.37Å; E153-R175 IonicContact OE2-CZ 3.26Å; E153-R175 IonicContact OE2-NE 2.7Å; E153-R175 PolarHBondContact OE2-NE 2.89Å; E153-R175 IonicContact OE2-NH2 2.68Å; R175-E179 IonicContact CZ-OE1 3.89Å; R175-E179 IonicContact NH1-OE1 2.72Å; R175-E179 PolarHBondContact NH1-OE1 3.45Å
176	W	88.8	Confident	86.8	Confident	122 Å²	122	84.3 Å²	84.3	46%	0.462	46%	0.458	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.4	137.8	166.1	-65.4	98.3	0	0	0	109.2	E149 G178 E179 K180	E149-W176 HydrophobicContact CB-CE3 4.18Å; E149-W176 HydrophobicContact CB-CZ3 4.02Å; W176-G178 PolarHBondContact O-N 2.97Å; W176-E179 HydrophobicContact CB-CB 4.47Å; W176-E179 WeakPolarHBondContact O-CB 3.36Å; W176-E179 PolarHBondContact O-N 2.88Å; W176-K180 PolarHBondContact O-N 3.13Å
177	V	87.5	Confident	87	Confident	45 Å²	45	85.1 Å²	85.1	27%	0.273	46%	0.462	S	S	.	.	H	α-helix	trans	-56	-37.6	-177.9	169.3	0	0	0	0	111.6	E149 C150 F151 L158 E179 K180 A181	E149-V177 VanDerWaalsContact C-CG2 3.43Å; E149-V177 WeakPolarHBondContact O-CG2 3.15Å; E149-V177 PolarHBondContact O-N 3.19Å; C150-V177 WeakPolarHBondContact O-CG2 3.42Å; F151-V177 HydrophobicContact CB-CG2 4.39Å; L158-V177 HydrophobicContact CD2-CG1 4.28Å; L158-V177 HydrophobicContact CD2-CG2 3.48Å; L158-V177 VanDerWaalsContact CD2-CG2 3.48Å; V177-E179 PolarHBondContact O-N 3.19Å; V177-K180 PolarHBondContact O-N 2.91Å; V177-A181 VanDerWaalsContact O-CB 3.29Å; V177-A181 WeakPolarHBondContact O-CB 3.35Å; V177-A181 PolarHBondContact O-N 3.31Å
178	G	84.2	Confident	87.3	Confident	49 Å²	49	85.5 Å²	85.5	51%	0.505	46%	0.46	S	S	.	.	H	α-helix	trans	-61.3	-40.7	175.1	0	0	0	0	0	113.6	W176 I182	W176-G178 PolarHBondContact O-N 2.97Å; G178-I182 WeakPolarHBondContact O-CG1 3.48Å; G178-I182 PolarHBondContact O-N 3.23Å
179	E	88.3	Confident	87.7	Confident	83 Å²	83	89 Å²	89	39%	0.388	48%	0.476	S	S	.	.	H	α-helix	trans	-68.5	-42.8	176.4	-167.5	-167.6	148.6	0	0	111	R175 W176 V177 A181 I182 Q183	R175-E179 IonicContact CZ-OE1 3.89Å; R175-E179 IonicContact NH1-OE1 2.72Å; R175-E179 PolarHBondContact NH1-OE1 3.45Å; W176-E179 HydrophobicContact CB-CB 4.47Å; W176-E179 WeakPolarHBondContact O-CB 3.36Å; W176-E179 PolarHBondContact O-N 2.88Å; V177-E179 PolarHBondContact O-N 3.19Å; E179-A181 VanDerWaalsContact C-N 3.34Å; E179-A181 PolarHBondContact O-N 3.15Å; E179-I182 PolarHBondContact O-N 3.43Å; E179-Q183 PolarHBondContact O-N 3.26Å
180	K	87.4	Confident	88.1	Confident	37 Å²	37	84 Å²	84	16%	0.161	46%	0.461	C	S	.	.	H	α-helix	trans	-64.7	-39.2	177.2	-169.4	62.8	173.5	-171.7	0	112	F151 E153 W176 V177 I182 Q183 L184	F151-K180 HydrophobicContact CB-CB 4.48Å; F151-K180 HydrophobicContact CD1-CB 4.48Å; F151-K180 HydrophobicContact CD1-CD 3.97Å; F151-K180 HydrophobicContact CD1-CG 3.8Å; F151-K180 HydrophobicContact CE1-CD 4.05Å; F151-K180 VanDerWaalsContact CE1-CE 3.5Å; F151-K180 HydrophobicContact CE1-CG 4.14Å; F151-K180 HydrophobicContact CG-CG 4.09Å; E153-K180 IonicContact OE1-NZ 3.34Å; E153-K180 PolarHBondContact OE1-NZ 3.19Å; W176-K180 PolarHBondContact O-N 3.13Å; V177-K180 PolarHBondContact O-N 2.91Å; K180-I182 VanDerWaalsContact C-N 3.3Å; K180-I182 PolarHBondContact O-N 3.03Å; K180-Q183 PolarHBondContact O-N 2.7Å; K180-Q183 VanDerWaalsContact O-N 3.17Å; K180-L184 HydrophobicContact CG-CD1 4.03Å; K180-L184 HydrophobicContact CG-CG 4.32Å; K180-L184 WeakPolarHBondContact O-CG 3.36Å; K180-L184 PolarHBondContact O-N 3.06Å
181	A	88.4	Confident	88.4	Confident	53 Å²	53	78.3 Å²	78.3	44%	0.438	44%	0.437	S	S	.	.	H	α-helix	trans	-59.6	-40.5	176.9	0	0	0	0	0	112	V177 E179 Q183 L184 K185	V177-A181 VanDerWaalsContact O-CB 3.29Å; V177-A181 WeakPolarHBondContact O-CB 3.35Å; V177-A181 PolarHBondContact O-N 3.31Å; E179-A181 VanDerWaalsContact C-N 3.34Å; E179-A181 PolarHBondContact O-N 3.15Å; A181-Q183 PolarHBondContact O-N 3.17Å; A181-L184 PolarHBondContact O-N 3.33Å; A181-K185 WeakPolarHBondContact O-CB 3.4Å; A181-K185 PolarHBondContact O-N 3.42Å
182	I	90.1	Very high	88.7	Confident	127 Å²	127	78.9 Å²	78.9	65%	0.651	44%	0.442	S	S	*	.	H	α-helix	trans	-63.1	-42.3	175.8	-65.9	164.2	0	0	0	110.9	G178 E179 K180 K185	G178-I182 WeakPolarHBondContact O-CG1 3.48Å; G178-I182 PolarHBondContact O-N 3.23Å; E179-I182 PolarHBondContact O-N 3.43Å; K180-I182 VanDerWaalsContact C-N 3.3Å; K180-I182 PolarHBondContact O-N 3.03Å; I182-K185 WeakPolarHBondContact O-CB 3.46Å; I182-K185 PolarHBondContact O-N 3.05Å
183	Q	87.2	Confident	89.6	Confident	79 Å²	79	81.4 Å²	81.4	37%	0.369	43%	0.431	S	S	.	.	H	α-helix	trans	-66.5	-36.8	177.6	-67	178.2	10	0	0	112.9	E179 K180 A181 K185 P187	E179-Q183 PolarHBondContact O-N 3.26Å; K180-Q183 PolarHBondContact O-N 2.7Å; K180-Q183 VanDerWaalsContact O-N 3.17Å; A181-Q183 PolarHBondContact O-N 3.17Å; Q183-K185 VanDerWaalsContact C-N 3.35Å; Q183-P187 WeakPolarHBondContact O-CD 3.19Å
184	L	89.9	Confident	90	Very high	92 Å²	92	82.4 Å²	82.4	48%	0.482	43%	0.432	S	S	.	.	H	α-helix	trans	-77.3	-21.3	179	-66.5	175.7	0	0	0	113	K180 A181 P187 L188	K180-L184 HydrophobicContact CG-CD1 4.03Å; K180-L184 HydrophobicContact CG-CG 4.32Å; K180-L184 WeakPolarHBondContact O-CG 3.36Å; K180-L184 PolarHBondContact O-N 3.06Å; A181-L184 PolarHBondContact O-N 3.33Å; L184-P187 WeakPolarHBondContact O-CD 3.44Å; L184-L188 WeakPolarHBondContact O-CD1 3.02Å; L184-L188 VanDerWaalsContact O-CG 3.27Å; L184-L188 WeakPolarHBondContact O-CG 3.08Å; L184-L188 PolarHBondContact O-N 3.28Å
185	K	91.7	Very high	90.3	Very high	119 Å²	119	83.7 Å²	83.7	52%	0.517	44%	0.442	S	S	.	.	H	α-helix	trans	-63.1	-50.2	-178.9	-178.3	177.3	171.2	-179.3	0	112.6	A181 I182 Q183 L188 E189	A181-K185 WeakPolarHBondContact O-CB 3.4Å; A181-K185 PolarHBondContact O-N 3.42Å; I182-K185 WeakPolarHBondContact O-CB 3.46Å; I182-K185 PolarHBondContact O-N 3.05Å; Q183-K185 VanDerWaalsContact C-N 3.35Å; K185-L188 PolarHBondContact O-N 3.34Å; K185-E189 VanDerWaalsContact CE-CD 3.45Å; K185-E189 WeakPolarHBondContact CE-OE1 3.46Å; K185-E189 HydrophobicContact CG-CG 4.21Å; K185-E189 IonicContact NZ-OE1 3.22Å; K185-E189 WeakPolarHBondContact O-CG 3.33Å; K185-E189 PolarHBondContact O-N 3.39Å
186	A	89.9	Confident	90.4	Very high	60 Å²	60	87.1 Å²	87.1	50%	0.496	46%	0.459	S	S	.	.	H	α-helix	trans	-62.7	-45.8	-174.8	0	0	0	0	0	113.7	L188 E189 E190	A186-L188 VanDerWaalsContact C-N 3.31Å; A186-L188 PolarHBondContact O-N 3.24Å; A186-E189 PolarHBondContact O-N 3.26Å; A186-E190 WeakPolarHBondContact O-CB 3.49Å; A186-E190 PolarHBondContact O-N 3.03Å
187	P	93.4	Very high	90.5	Very high	85 Å²	85	85 Å²	85	55%	0.552	45%	0.454	S	S	*	.	H	α-helix	trans	-61.2	-35.6	173.6	-24.6	34.4	0	0	0	113.7	Q183 L184 G191	Q183-P187 WeakPolarHBondContact O-CD 3.19Å; L184-P187 WeakPolarHBondContact O-CD 3.44Å; P187-G191 PolarHBondContact O-N 3.27Å
188	L	92.5	Very high	90.6	Very high	116 Å²	116	85.5 Å²	85.5	61%	0.607	46%	0.46	S	S	*	.	H	α-helix	trans	-69.6	-43.6	176.7	-73.2	171.7	0	0	0	111.9	L184 K185 A186 E190 G191 I192	L184-L188 WeakPolarHBondContact O-CD1 3.02Å; L184-L188 VanDerWaalsContact O-CG 3.27Å; L184-L188 WeakPolarHBondContact O-CG 3.08Å; L184-L188 PolarHBondContact O-N 3.28Å; K185-L188 PolarHBondContact O-N 3.34Å; A186-L188 VanDerWaalsContact C-N 3.31Å; A186-L188 PolarHBondContact O-N 3.24Å; L188-E190 VanDerWaalsContact C-N 3.3Å; L188-E190 PolarHBondContact O-N 3.15Å; L188-G191 PolarHBondContact O-N 3.46Å; L188-I192 VanDerWaalsContact O-CG1 3.25Å; L188-I192 WeakPolarHBondContact O-CG1 3.42Å; L188-I192 PolarHBondContact O-N 3.29Å
189	E	92.8	Very high	90.9	Very high	104 Å²	104	84.9 Å²	84.9	49%	0.486	45%	0.453	S	S	.	.	H	α-helix	trans	-60.6	-41.3	175.9	-74.2	178.5	152.2	0	0	111.6	K185 A186 I192 R193	K185-E189 VanDerWaalsContact CE-CD 3.45Å; K185-E189 WeakPolarHBondContact CE-OE1 3.46Å; K185-E189 HydrophobicContact CG-CG 4.21Å; K185-E189 IonicContact NZ-OE1 3.22Å; K185-E189 WeakPolarHBondContact O-CG 3.33Å; K185-E189 PolarHBondContact O-N 3.39Å; A186-E189 PolarHBondContact O-N 3.26Å; E189-I192 PolarHBondContact O-N 3.03Å; E189-R193 WeakPolarHBondContact O-CB 3.2Å; E189-R193 PolarHBondContact O-N 3.13Å
190	E	92.4	Very high	90.9	Very high	80 Å²	80	87.6 Å²	87.6	37%	0.374	47%	0.466	S	S	.	.	H	α-helix	trans	-64.2	-45.3	173.9	174.2	54.3	-157.2	0	0	112.1	A186 L188 I192 R193 N194	A186-E190 WeakPolarHBondContact O-CB 3.49Å; A186-E190 PolarHBondContact O-N 3.03Å; L188-E190 VanDerWaalsContact C-N 3.3Å; L188-E190 PolarHBondContact O-N 3.15Å; E190-I192 VanDerWaalsContact C-N 3.34Å; E190-I192 PolarHBondContact O-N 3.04Å; E190-R193 WeakPolarHBondContact O-CB 3.25Å; E190-R193 PolarHBondContact O-N 3.32Å; E190-R193 IonicContact OE1-CZ 3.53Å; E190-R193 IonicContact OE1-NE 3.98Å; E190-R193 IonicContact OE1-NH2 3.45Å; E190-R193 PolarHBondContact OE1-NH2 3.34Å; E190-R193 IonicContact OE2-CZ 2.75Å; E190-R193 VanDerWaalsContact OE2-CZ 3.27Å; E190-R193 IonicContact OE2-NE 3.23Å; E190-R193 PolarHBondContact OE2-NE 3.19Å; E190-R193 IonicContact OE2-NH2 2.99Å; E190-R193 PolarHBondContact OE2-NH2 3.36Å; E190-N194 PolarHBondContact O-N 3.04Å; E190-N194 PolarHBondContact O-ND2 2.93Å; E190-N194 PolarHBondContact OE1-ND2 3.26Å; E190-N194 PolarHBondContact OE1-OD1 3.48Å
191	G	93.2	Very high	91	Very high	31 Å²	31	90.7 Å²	90.7	32%	0.32	48%	0.479	S	S	.	.	H	α-helix	trans	-59.1	-42.6	173.9	0	0	0	0	0	112.9	P187 L188 N194 L195	P187-G191 PolarHBondContact O-N 3.27Å; L188-G191 PolarHBondContact O-N 3.46Å; G191-N194 PolarHBondContact O-N 2.77Å; G191-L195 WeakPolarHBondContact O-CG 3.08Å; G191-L195 PolarHBondContact O-N 3.18Å
192	I	92.5	Very high	91.1	Very high	89 Å²	89	94 Å²	94	46%	0.456	49%	0.489	S	S	.	.	H	α-helix	trans	-62.9	-42.4	175.2	-69.9	164.6	0	0	0	110.9	L188 E189 E190 L195 K196	L188-I192 VanDerWaalsContact O-CG1 3.25Å; L188-I192 WeakPolarHBondContact O-CG1 3.42Å; L188-I192 PolarHBondContact O-N 3.29Å; E189-I192 PolarHBondContact O-N 3.03Å; E190-I192 VanDerWaalsContact C-N 3.34Å; E190-I192 PolarHBondContact O-N 3.04Å; I192-L195 PolarHBondContact O-N 3.27Å; I192-K196 HydrophobicContact CG2-CD 4.16Å; I192-K196 HydrophobicContact CG2-CG 4.45Å; I192-K196 WeakPolarHBondContact O-CG 3.13Å; I192-K196 PolarHBondContact O-N 3.45Å
193	R	93.1	Very high	91.1	Very high	121 Å²	121	91.8 Å²	91.8	46%	0.457	49%	0.485	S	S	.	.	H	α-helix	trans	-59.8	-47	177.3	-172.5	-173.1	65.9	72	-1.3	111.1	E189 E190 K196 E197	E189-R193 WeakPolarHBondContact O-CB 3.2Å; E189-R193 PolarHBondContact O-N 3.13Å; E190-R193 WeakPolarHBondContact O-CB 3.25Å; E190-R193 PolarHBondContact O-N 3.32Å; E190-R193 IonicContact OE1-CZ 3.53Å; E190-R193 IonicContact OE1-NE 3.98Å; E190-R193 IonicContact OE1-NH2 3.45Å; E190-R193 PolarHBondContact OE1-NH2 3.34Å; E190-R193 IonicContact OE2-CZ 2.75Å; E190-R193 VanDerWaalsContact OE2-CZ 3.27Å; E190-R193 IonicContact OE2-NE 3.23Å; E190-R193 PolarHBondContact OE2-NE 3.19Å; E190-R193 IonicContact OE2-NH2 2.99Å; E190-R193 PolarHBondContact OE2-NH2 3.36Å; R193-K196 PolarHBondContact O-N 3.34Å; R193-E197 IonicContact NH1-OE2 3.65Å; R193-E197 PolarHBondContact O-N 2.72Å; R193-E197 VanDerWaalsContact O-N 3.07Å
194	N	92	Very high	91	Very high	63 Å²	63	90.2 Å²	90.2	34%	0.337	48%	0.483	S	S	.	.	H	α-helix	trans	-64.9	-39.2	178.6	-67.1	-26.4	0	0	0	112.2	E190 G191 E197 S198	E190-N194 PolarHBondContact O-N 3.04Å; E190-N194 PolarHBondContact O-ND2 2.93Å; E190-N194 PolarHBondContact OE1-ND2 3.26Å; E190-N194 PolarHBondContact OE1-OD1 3.48Å; G191-N194 PolarHBondContact O-N 2.77Å; N194-E197 PolarHBondContact O-N 3.37Å; N194-S198 WeakPolarHBondContact O-CB 3.32Å; N194-S198 PolarHBondContact O-N 3.41Å; N194-S198 PolarHBondContact O-OG 3.44Å
195	L	92.3	Very high	90.9	Very high	128 Å²	128	88.1 Å²	88.1	67%	0.67	48%	0.479	S	S	*	.	H	α-helix	trans	-66.6	-39.3	175.1	-77.3	172.2	0	0	0	112.6	G191 I192 E197 S198 G199	G191-L195 WeakPolarHBondContact O-CG 3.08Å; G191-L195 PolarHBondContact O-N 3.18Å; I192-L195 PolarHBondContact O-N 3.27Å; L195-E197 VanDerWaalsContact C-N 3.35Å; L195-S198 PolarHBondContact O-N 3.03Å; L195-G199 PolarHBondContact O-N 3.12Å
196	K	91.4	Very high	90.8	Very high	146 Å²	146	87.9 Å²	87.9	64%	0.635	48%	0.482	S	S	*	.	H	α-helix	trans	-62.1	-42.3	174.7	-76.8	177.8	179.1	179.2	0	111.8	I192 R193 G199 Q200	I192-K196 HydrophobicContact CG2-CD 4.16Å; I192-K196 HydrophobicContact CG2-CG 4.45Å; I192-K196 WeakPolarHBondContact O-CG 3.13Å; I192-K196 PolarHBondContact O-N 3.45Å; R193-K196 PolarHBondContact O-N 3.34Å; K196-G199 PolarHBondContact O-N 3.48Å; K196-Q200 WeakPolarHBondContact O-CG 3.46Å; K196-Q200 PolarHBondContact O-N 2.91Å; K196-Q200 VanDerWaalsContact O-N 3.09Å
197	E	89.6	Confident	90.6	Very high	77 Å²	77	90.9 Å²	90.9	36%	0.36	49%	0.49	S	S	.	.	H	α-helix	trans	-64.6	-45.6	176.1	-168.1	-170.3	146.4	0	0	111.5	R193 N194 L195 G199 Q200 K201	R193-E197 IonicContact NH1-OE2 3.65Å; R193-E197 PolarHBondContact O-N 2.72Å; R193-E197 VanDerWaalsContact O-N 3.07Å; N194-E197 PolarHBondContact O-N 3.37Å; L195-E197 VanDerWaalsContact C-N 3.35Å; E197-G199 VanDerWaalsContact C-N 3.3Å; E197-G199 PolarHBondContact O-N 3.29Å; E197-Q200 WeakPolarHBondContact O-CB 3.48Å; E197-Q200 PolarHBondContact O-N 3.16Å; E197-K201 WeakPolarHBondContact O-CG 3.37Å; E197-K201 PolarHBondContact O-N 2.81Å; E197-K201 WeakPolarHBondContact OE1-CE 3.37Å; E197-K201 IonicContact OE1-NZ 2.83Å; E197-K201 PolarHBondContact OE1-NZ 3.38Å
198	S	91.3	Very high	90	Very high	56 Å²	56	90.8 Å²	90.8	39%	0.392	49%	0.49	S	S	.	.	H	α-helix	trans	-60.5	-38	173.8	-68.4	0	0	0	0	112.5	N194 L195 Q200 K201 L202	N194-S198 WeakPolarHBondContact O-CB 3.32Å; N194-S198 PolarHBondContact O-N 3.41Å; N194-S198 PolarHBondContact O-OG 3.44Å; L195-S198 PolarHBondContact O-N 3.03Å; S198-Q200 VanDerWaalsContact C-N 3.35Å; S198-Q200 PolarHBondContact O-N 3.11Å; S198-K201 PolarHBondContact O-N 2.79Å; S198-L202 WeakPolarHBondContact O-CG 3.15Å; S198-L202 PolarHBondContact O-N 3.02Å
199	G	89.5	Confident	89.5	Confident	36 Å²	36	87.9 Å²	87.9	37%	0.371	48%	0.483	S	S	.	.	H	α-helix	trans	-61.1	-40.4	173.8	0	0	0	0	0	112.9	L195 K196 E197 L202 S203	L195-G199 PolarHBondContact O-N 3.12Å; K196-G199 PolarHBondContact O-N 3.48Å; E197-G199 VanDerWaalsContact C-N 3.3Å; E197-G199 PolarHBondContact O-N 3.29Å; G199-L202 PolarHBondContact O-N 3.06Å; G199-S203 PolarHBondContact O-N 3.4Å
200	Q	87.8	Confident	89	Confident	141 Å²	141	85.2 Å²	85.2	66%	0.659	47%	0.473	S	S	*	.	H	α-helix	trans	-65.8	-41.8	174.2	-69.3	173.6	-8.1	0	0	112	K196 E197 S198 L202 S203 S204	K196-Q200 WeakPolarHBondContact O-CG 3.46Å; K196-Q200 PolarHBondContact O-N 2.91Å; K196-Q200 VanDerWaalsContact O-N 3.09Å; E197-Q200 WeakPolarHBondContact O-CB 3.48Å; E197-Q200 PolarHBondContact O-N 3.16Å; S198-Q200 VanDerWaalsContact C-N 3.35Å; S198-Q200 PolarHBondContact O-N 3.11Å; Q200-L202 VanDerWaalsContact C-N 3.35Å; Q200-S203 PolarHBondContact O-N 3.29Å; Q200-S204 PolarHBondContact O-N 3.48Å
201	K	89.1	Confident	88.3	Confident	101 Å²	101	83.4 Å²	83.4	44%	0.439	47%	0.47	S	S	.	.	H	α-helix	trans	-61.9	-40.7	174.3	-68.3	172.3	-175.8	166.8	0	112	E197 S198 S204 A205	E197-K201 WeakPolarHBondContact O-CG 3.37Å; E197-K201 PolarHBondContact O-N 2.81Å; E197-K201 WeakPolarHBondContact OE1-CE 3.37Å; E197-K201 IonicContact OE1-NZ 2.83Å; E197-K201 PolarHBondContact OE1-NZ 3.38Å; S198-K201 PolarHBondContact O-N 2.79Å; K201-S204 PolarHBondContact O-N 3.12Å; K201-S204 PolarHBondContact O-OG 3.48Å; K201-A205 WeakPolarHBondContact O-CB 3.47Å; K201-A205 PolarHBondContact O-N 3.07Å
202	L	91.2	Very high	87.5	Confident	123 Å²	123	84.2 Å²	84.2	64%	0.644	47%	0.473	S	S	*	.	H	α-helix	trans	-67.3	-38.2	175.3	-72.7	170.9	0	0	0	111.8	S198 G199 Q200 S204 A205 L206	S198-L202 WeakPolarHBondContact O-CG 3.15Å; S198-L202 PolarHBondContact O-N 3.02Å; G199-L202 PolarHBondContact O-N 3.06Å; Q200-L202 VanDerWaalsContact C-N 3.35Å; L202-S204 PolarHBondContact O-N 3.31Å; L202-A205 PolarHBondContact O-N 2.99Å; L202-L206 WeakPolarHBondContact O-CB 3.47Å; L202-L206 PolarHBondContact O-N 3.03Å
203	S	89.7	Confident	86.7	Confident	80 Å²	80	87.5 Å²	87.5	56%	0.559	48%	0.48	S	S	*	.	H	α-helix	trans	-63.3	-40.2	175.6	-171.3	0	0	0	0	112.2	G199 Q200 L207	G199-S203 PolarHBondContact O-N 3.4Å; Q200-S203 PolarHBondContact O-N 3.29Å; S203-L207 PolarHBondContact O-N 3.33Å; S203-L207 VanDerWaalsContact O-N 3.13Å
204	S	86.3	Confident	85.8	Confident	47 Å²	47	86.2 Å²	86.2	33%	0.329	49%	0.486	S	S	.	.	H	α-helix	trans	-71	-37.5	175.8	64.1	0	0	0	0	112	Q200 K201 L202 L207 C208	Q200-S204 PolarHBondContact O-N 3.48Å; K201-S204 PolarHBondContact O-N 3.12Å; K201-S204 PolarHBondContact O-OG 3.48Å; L202-S204 PolarHBondContact O-N 3.31Å; S204-L207 PolarHBondContact O-N 2.93Å; S204-C208 PolarHBondContact O-N 2.85Å
205	A	87.6	Confident	84.8	Confident	48 Å²	48	86.1 Å²	86.1	40%	0.397	49%	0.489	S	S	.	.	H	α-helix	trans	-62.1	-42	172.4	0	0	0	0	0	112.4	K201 L202 L207 C208 A209	K201-A205 WeakPolarHBondContact O-CB 3.47Å; K201-A205 PolarHBondContact O-N 3.07Å; L202-A205 PolarHBondContact O-N 2.99Å; A205-L207 PolarHBondContact O-N 2.9Å; A205-C208 WeakPolarHBondContact O-CB 3.3Å; A205-C208 PolarHBondContact O-N 3.1Å; A205-A209 PolarHBondContact O-N 3.01Å
206	L	88.9	Confident	83.6	Confident	113 Å²	113	86.8 Å²	86.8	59%	0.592	49%	0.492	S	S	*	.	H	α-helix	trans	-62.7	-41.9	176.4	179	62.6	0	0	0	112	L202 C208 A209 T210	L202-L206 WeakPolarHBondContact O-CB 3.47Å; L202-L206 PolarHBondContact O-N 3.03Å; L206-C208 VanDerWaalsContact C-N 3.34Å; L206-A209 PolarHBondContact O-N 3.32Å; L206-T210 WeakPolarHBondContact O-CB 3.31Å; L206-T210 PolarHBondContact O-N 2.86Å; L206-T210 PolarHBondContact O-OG1 3.38Å
207	L	86.1	Confident	82.3	Confident	124 Å²	124	87.5 Å²	87.5	65%	0.649	50%	0.498	S	S	*	.	H	α-helix	trans	-60.8	-44.6	174.6	179.7	63	0	0	0	111	S203 S204 A205 T210 S211	S203-L207 PolarHBondContact O-N 3.33Å; S203-L207 VanDerWaalsContact O-N 3.13Å; S204-L207 PolarHBondContact O-N 2.93Å; A205-L207 PolarHBondContact O-N 2.9Å; L207-T210 PolarHBondContact O-N 3.31Å; L207-S211 WeakPolarHBondContact O-CB 3.31Å; L207-S211 PolarHBondContact O-N 3.26Å; L207-S211 PolarHBondContact O-OG 3.45Å
208	C	81	Confident	81.2	Confident	83 Å²	83	89.3 Å²	89.3	56%	0.561	51%	0.51	S	S	*	.	H	α-helix	trans	-62.1	-45.8	177.3	-169.5	0	0	0	0	112.4	S204 A205 L206 T210 S211 A212	S204-C208 PolarHBondContact O-N 2.85Å; A205-C208 WeakPolarHBondContact O-CB 3.3Å; A205-C208 PolarHBondContact O-N 3.1Å; L206-C208 VanDerWaalsContact C-N 3.34Å; C208-T210 VanDerWaalsContact C-N 3.28Å; C208-T210 PolarHBondContact O-N 2.76Å; C208-S211 PolarHBondContact O-N 3.05Å; C208-S211 PolarHBondContact O-OG 3.17Å; C208-S211 VanDerWaalsContact O-OG 3.06Å; C208-A212 WeakPolarHBondContact O-CB 3.47Å; C208-A212 PolarHBondContact O-N 2.8Å
209	A	81.4	Confident	80.4	Confident	55 Å²	55	87.1 Å²	87.1	46%	0.455	50%	0.495	S	S	.	.	H	α-helix	trans	-65.3	-31.2	177.5	0	0	0	0	0	112.8	A205 L206 R213	A205-A209 PolarHBondContact O-N 3.01Å; L206-A209 PolarHBondContact O-N 3.32Å; A209-R213 PolarHBondContact O-NE 2.88Å
210	T	82	Confident	80	Confident	47 Å²	47	91.6 Å²	91.6	29%	0.288	50%	0.504	S	S	.	.	H	α-helix	trans	-77.6	-45.9	177.6	-54.8	0	0	0	0	111.2	L206 L207 C208 A212 R213 T214	L206-T210 WeakPolarHBondContact O-CB 3.31Å; L206-T210 PolarHBondContact O-N 2.86Å; L206-T210 PolarHBondContact O-OG1 3.38Å; L207-T210 PolarHBondContact O-N 3.31Å; C208-T210 VanDerWaalsContact C-N 3.28Å; C208-T210 PolarHBondContact O-N 2.76Å; T210-A212 VanDerWaalsContact C-N 3.32Å; T210-A212 PolarHBondContact O-N 2.88Å; T210-R213 WeakPolarHBondContact O-CB 3.46Å; T210-R213 PolarHBondContact O-N 2.9Å; T210-T214 HydrophobicContact CG2-CG2 4.33Å; T210-T214 PolarHBondContact O-N 3.1Å; T210-T214 PolarHBondContact O-OG1 3.47Å
211	S	78.6	Confident	79.8	Confident	42 Å²	42	89.9 Å²	89.9	29%	0.294	50%	0.498	S	S	.	.	H	α-helix	trans	-63.2	-36.1	178.5	66.1	0	0	0	0	112.7	L207 C208 R213 T214 C215	L207-S211 WeakPolarHBondContact O-CB 3.31Å; L207-S211 PolarHBondContact O-N 3.26Å; L207-S211 PolarHBondContact O-OG 3.45Å; C208-S211 PolarHBondContact O-N 3.05Å; C208-S211 PolarHBondContact O-OG 3.17Å; C208-S211 VanDerWaalsContact O-OG 3.06Å; S211-R213 PolarHBondContact O-N 2.99Å; S211-T214 PolarHBondContact O-N 3.36Å; S211-C215 WeakPolarHBondContact O-CB 3.37Å; S211-C215 PolarHBondContact O-N 3.31Å
212	A	75.9	Confident	79.4	Confident	48 Å²	48	89.5 Å²	89.5	40%	0.397	50%	0.497	S	S	.	.	H	α-helix	trans	-58.6	-27	173.4	0	0	0	0	0	113.4	C208 T210 S219 F220	C208-A212 WeakPolarHBondContact O-CB 3.47Å; C208-A212 PolarHBondContact O-N 2.8Å; T210-A212 VanDerWaalsContact C-N 3.32Å; T210-A212 PolarHBondContact O-N 2.88Å; A212-S219 WeakPolarHBondContact O-CA 3.44Å; A212-S219 VanDerWaalsContact O-CB 3.28Å; A212-S219 WeakPolarHBondContact O-CB 3.39Å; A212-F220 PolarHBondContact O-N 2.89Å
213	R	75	Confident	79.1	Confident	159 Å²	159	87.3 Å²	87.3	60%	0.6	49%	0.492	S	S	*	.	H	α-helix	trans	-89.3	-34.4	175.2	-66.6	-177.6	-67.2	164.2	3	113.2	A209 T210 S211 I221	A209-R213 PolarHBondContact O-NE 2.88Å; T210-R213 WeakPolarHBondContact O-CB 3.46Å; T210-R213 PolarHBondContact O-N 2.9Å; S211-R213 PolarHBondContact O-N 2.99Å; R213-I221 WeakPolarHBondContact O-CD1 3.39Å
214	T	75.6	Confident	79	Confident	94 Å²	94	85.2 Å²	85.2	58%	0.577	48%	0.475	S	S	*	.	H	α-helix	trans	-102.3	-20.9	-169.1	60.2	0	0	0	0	115.7	T210 S211 I216	T210-T214 HydrophobicContact CG2-CG2 4.33Å; T210-T214 PolarHBondContact O-N 3.1Å; T210-T214 PolarHBondContact O-OG1 3.47Å; S211-T214 PolarHBondContact O-N 3.36Å; T214-I216 PolarHBondContact O-N 2.93Å
215	C	70.8	Confident	79.2	Confident	60 Å²	60	87.4 Å²	87.4	41%	0.405	48%	0.48	S	S	.	.			trans	-72.2	121.4	-176.4	-77.6	0	0	0	0	112.3	S211 S219	S211-C215 WeakPolarHBondContact O-CB 3.37Å; S211-C215 PolarHBondContact O-N 3.31Å; C215-S219 WeakPolarHBondContact O-CA 3.24Å; C215-S219 WeakPolarHBondContact O-CB 3.35Å; C215-S219 PolarHBondContact O-N 2.95Å; C215-S219 PolarHBondContact O-OG 3.3Å
216	I	67.2	Low	79.2	Confident	142 Å²	142	90.5 Å²	90.5	73%	0.728	49%	0.485	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.7	-51.6	-164.9	-62.3	168.1	0	0	0	113.8	T214 F222	T214-I216 PolarHBondContact O-N 2.93Å; I216-F222 WeakPolarHBondContact O-CB 3.48Å; I216-F222 WeakPolarHBondContact O-CG 3.34Å
217	E	64.2	Low	79.3	Confident	162 Å²	162	87 Å²	87	76%	0.757	47%	0.473	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85	-20.6	-172.6	-67.3	174.5	173.2	0	0	113.5	F222	E217-F222 VanDerWaalsContact O-CD1 3.26Å; E217-F222 WeakPolarHBondContact O-CD1 3.45Å
218	D	66.4	Low	79.6	Confident	114 Å²	114	87.8 Å²	87.8	61%	0.61	47%	0.467	S	S	*	.	T	Hydrogen-bonded Turn	trans	-120.9	4.1	-167.7	-120.2	36.8	0	0	0	112.9	K383	D218-K383 IonicContact OD2-NZ 2.99Å; D218-K383 PolarHBondContact OD2-NZ 3.06Å
219	S	75.2	Confident	80.2	Confident	11 Å²	11	89.5 Å²	89.5	8%	0.077	47%	0.466	C	S	.	.	S	Bend	trans	-77.6	155.3	178.3	55.7	0	0	0	0	112.2	A212 C215 I221 F222 S223	A212-S219 WeakPolarHBondContact O-CA 3.44Å; A212-S219 VanDerWaalsContact O-CB 3.28Å; A212-S219 WeakPolarHBondContact O-CB 3.39Å; C215-S219 WeakPolarHBondContact O-CA 3.24Å; C215-S219 WeakPolarHBondContact O-CB 3.35Å; C215-S219 PolarHBondContact O-N 2.95Å; C215-S219 PolarHBondContact O-OG 3.3Å; S219-I221 PolarHBondContact O-N 3.41Å; S219-F222 PolarHBondContact O-N 3.35Å; S219-F222 PolarHBondContact OG-N 3.34Å; S219-S223 PolarHBondContact O-N 3.37Å; S219-S223 VanDerWaalsContact O-N 3.14Å
220	F	79.3	Confident	80.6	Confident	129 Å²	129	90.8 Å²	90.8	57%	0.566	47%	0.466	S	S	*	.	H	α-helix	trans	-51.8	-38.9	165.7	177.8	-105	0	0	0	112.4	A212 S223 V224 W380	A212-F220 PolarHBondContact O-N 2.89Å; F220-S223 WeakPolarHBondContact O-CB 3.49Å; F220-S223 PolarHBondContact O-N 3.4Å; F220-V224 HydrophobicContact CE1-CG2 4.12Å; F220-V224 HydrophobicContact CE2-CG2 4.32Å; F220-V224 HydrophobicContact CZ-CG2 4.02Å; F220-V224 WeakPolarHBondContact O-CG2 3.46Å; F220-V224 PolarHBondContact O-N 3.44Å; F220-V224 VanDerWaalsContact O-N 3.08Å; F220-W380 HydrophobicContact CE2-CE3 4.14Å; F220-W380 AromaticContact CE2-CZ3 3.7Å; F220-W380 HydrophobicContact CE2-CZ3 3.7Å; F220-W380 HydrophobicContact CZ-CH2 4.49Å; F220-W380 AromaticContact CZ-CZ3 3.78Å; F220-W380 HydrophobicContact CZ-CZ3 3.78Å
221	I	83.7	Confident	80.9	Confident	105 Å²	105	92.6 Å²	92.6	54%	0.538	47%	0.473	S	S	.	.	H	α-helix	trans	-64.5	-45	-178.7	-58.7	-179.4	0	0	0	111.2	R213 S219 V224 E225	R213-I221 WeakPolarHBondContact O-CD1 3.39Å; S219-I221 PolarHBondContact O-N 3.41Å; I221-V224 PolarHBondContact O-N 2.93Å; I221-E225 PolarHBondContact O-N 2.93Å
222	F	82.5	Confident	81.6	Confident	94 Å²	94	97.3 Å²	97.3	41%	0.412	49%	0.488	S	S	.	.	H	α-helix	trans	-65.5	-40.6	177.7	179.6	-96.4	0	0	0	112.3	I216 E217 S219 V224 E225 K226	I216-F222 WeakPolarHBondContact O-CB 3.48Å; I216-F222 WeakPolarHBondContact O-CG 3.34Å; E217-F222 VanDerWaalsContact O-CD1 3.26Å; E217-F222 WeakPolarHBondContact O-CD1 3.45Å; S219-F222 PolarHBondContact O-N 3.35Å; S219-F222 PolarHBondContact OG-N 3.34Å; F222-V224 VanDerWaalsContact C-N 3.25Å; F222-V224 PolarHBondContact O-N 2.64Å; F222-E225 PolarHBondContact O-N 2.79Å; F222-K226 HydrophobicContact CE1-CD 4.45Å; F222-K226 WeakPolarHBondContact O-CB 3.23Å; F222-K226 PolarHBondContact O-N 2.88Å
223	S	84.4	Confident	82.4	Confident	76 Å²	76	99.9 Å²	99.9	53%	0.531	50%	0.495	S	S	.	.	H	α-helix	trans	-56.6	-40.9	173.6	-174	0	0	0	0	112	S219 F220 A227	S219-S223 PolarHBondContact O-N 3.37Å; S219-S223 VanDerWaalsContact O-N 3.14Å; F220-S223 WeakPolarHBondContact O-CB 3.49Å; F220-S223 PolarHBondContact O-N 3.4Å; S223-A227 WeakPolarHBondContact O-CB 3.39Å; S223-A227 PolarHBondContact O-N 2.77Å; S223-A227 VanDerWaalsContact O-N 3.09Å
224	V	87.9	Confident	83.1	Confident	36 Å²	36	97.3 Å²	97.3	22%	0.218	49%	0.485	C	S	.	.	H	α-helix	trans	-68.3	-42.9	177.1	170.5	0	0	0	0	111.5	F220 I221 F222 A227 R228 W380	F220-V224 HydrophobicContact CE1-CG2 4.12Å; F220-V224 HydrophobicContact CE2-CG2 4.32Å; F220-V224 HydrophobicContact CZ-CG2 4.02Å; F220-V224 WeakPolarHBondContact O-CG2 3.46Å; F220-V224 PolarHBondContact O-N 3.44Å; F220-V224 VanDerWaalsContact O-N 3.08Å; I221-V224 PolarHBondContact O-N 2.93Å; F222-V224 VanDerWaalsContact C-N 3.25Å; F222-V224 PolarHBondContact O-N 2.64Å; V224-A227 PolarHBondContact O-N 3.27Å; V224-R228 WeakPolarHBondContact O-CG 3.22Å; V224-R228 PolarHBondContact O-N 2.82Å; V224-W380 HydrophobicContact CG2-CH2 4.34Å; V224-W380 HydrophobicContact CG2-CZ3 4.18Å
225	E	89	Confident	83.8	Confident	93 Å²	93	96 Å²	96	44%	0.435	48%	0.477	S	S	.	.	H	α-helix	trans	-69.2	-38	-179.1	-163.9	56.7	-147.8	0	0	112.2	I221 F222 R228 Q229	I221-E225 PolarHBondContact O-N 2.93Å; F222-E225 PolarHBondContact O-N 2.79Å; E225-R228 WeakPolarHBondContact O-CB 3.39Å; E225-R228 PolarHBondContact O-N 3.06Å; E225-R228 WeakPolarHBondContact OE2-CD 3.49Å; E225-R228 IonicContact OE2-CZ 2.87Å; E225-R228 IonicContact OE2-NH1 3.96Å; E225-R228 PolarHBondContact OE2-NH1 2.74Å; E225-Q229 PolarHBondContact O-N 2.81Å
226	K	88.7	Confident	84.8	Confident	114 Å²	114	96.1 Å²	96.1	50%	0.496	48%	0.479	S	S	.	.	H	α-helix	trans	-60.3	-48	171.3	-175.2	176.5	179.1	-178.9	0	111.4	F222 R228 Q229 D230	F222-K226 HydrophobicContact CE1-CD 4.45Å; F222-K226 WeakPolarHBondContact O-CB 3.23Å; F222-K226 PolarHBondContact O-N 2.88Å; K226-R228 VanDerWaalsContact C-N 3.28Å; K226-R228 PolarHBondContact O-N 3.27Å; K226-Q229 WeakPolarHBondContact O-CB 3.24Å; K226-Q229 PolarHBondContact O-N 2.85Å; K226-D230 PolarHBondContact O-N 3.49Å
227	A	89.8	Confident	85.9	Confident	40 Å²	40	91.8 Å²	91.8	33%	0.331	46%	0.461	S	S	.	.	H	α-helix	trans	-59.1	-38.8	176.9	0	0	0	0	0	112.2	S223 V224 Q229 D230 I231	S223-A227 WeakPolarHBondContact O-CB 3.39Å; S223-A227 PolarHBondContact O-N 2.77Å; S223-A227 VanDerWaalsContact O-N 3.09Å; V224-A227 PolarHBondContact O-N 3.27Å; A227-Q229 PolarHBondContact O-N 3.45Å; A227-D230 PolarHBondContact O-N 3.2Å; A227-I231 WeakPolarHBondContact O-CD1 3.28Å; A227-I231 VanDerWaalsContact O-CG1 3.23Å; A227-I231 WeakPolarHBondContact O-CG1 3.35Å; A227-I231 PolarHBondContact O-N 3.44Å
228	R	92.9	Very high	87.1	Confident	139 Å²	139	86.2 Å²	86.2	53%	0.525	44%	0.436	S	S	.	.	H	α-helix	trans	-62.1	-41.1	173.7	-75	170.7	173.3	174.5	-2.3	112.7	V224 E225 K226 K232	V224-R228 WeakPolarHBondContact O-CG 3.22Å; V224-R228 PolarHBondContact O-N 2.82Å; E225-R228 WeakPolarHBondContact O-CB 3.39Å; E225-R228 PolarHBondContact O-N 3.06Å; E225-R228 WeakPolarHBondContact OE2-CD 3.49Å; E225-R228 IonicContact OE2-CZ 2.87Å; E225-R228 IonicContact OE2-NH1 3.96Å; E225-R228 PolarHBondContact OE2-NH1 2.74Å; K226-R228 VanDerWaalsContact C-N 3.28Å; K226-R228 PolarHBondContact O-N 3.27Å; R228-K232 WeakPolarHBondContact O-CG 3.3Å; R228-K232 PolarHBondContact O-N 2.98Å
229	Q	93	Very high	88.2	Confident	119 Å²	119	84.6 Å²	84.6	56%	0.556	43%	0.427	S	S	*	.	H	α-helix	trans	-66.1	-44.4	177.4	-173	174.9	3.2	0	0	111.1	E225 K226 A227 I231 K232 L233	E225-Q229 PolarHBondContact O-N 2.81Å; K226-Q229 WeakPolarHBondContact O-CB 3.24Å; K226-Q229 PolarHBondContact O-N 2.85Å; A227-Q229 PolarHBondContact O-N 3.45Å; Q229-I231 VanDerWaalsContact C-N 3.34Å; Q229-I231 PolarHBondContact O-N 2.84Å; Q229-K232 PolarHBondContact O-N 3.41Å; Q229-L233 HydrophobicContact CG-CD1 4.11Å; Q229-L233 HydrophobicContact CG-CG 4.47Å; Q229-L233 WeakPolarHBondContact O-CG 3.46Å; Q229-L233 PolarHBondContact O-N 3.43Å
230	D	90.2	Very high	89	Confident	83 Å²	83	88.2 Å²	88.2	44%	0.444	45%	0.445	S	S	.	.	H	α-helix	trans	-61.2	-41.7	178.6	-66.8	-20.4	0	0	0	111.6	K226 A227 K232 L233 R234	K226-D230 PolarHBondContact O-N 3.49Å; A227-D230 PolarHBondContact O-N 3.2Å; D230-K232 PolarHBondContact O-N 3.41Å; D230-L233 PolarHBondContact O-N 3.42Å; D230-R234 WeakPolarHBondContact O-CB 3.45Å; D230-R234 PolarHBondContact O-N 3.48Å
231	I	89.2	Confident	89.5	Confident	84 Å²	84	84.6 Å²	84.6	43%	0.431	44%	0.435	S	S	.	.	H	α-helix	trans	-57.1	-50.3	173.8	-70.2	164.1	0	0	0	110.7	A227 Q229 L233 R234 T235 I378	A227-I231 WeakPolarHBondContact O-CD1 3.28Å; A227-I231 VanDerWaalsContact O-CG1 3.23Å; A227-I231 WeakPolarHBondContact O-CG1 3.35Å; A227-I231 PolarHBondContact O-N 3.44Å; Q229-I231 VanDerWaalsContact C-N 3.34Å; Q229-I231 PolarHBondContact O-N 2.84Å; I231-L233 PolarHBondContact O-N 2.85Å; I231-R234 PolarHBondContact O-N 3Å; I231-T235 PolarHBondContact O-N 2.93Å; I231-T235 PolarHBondContact O-OG1 3.11Å; I231-T235 VanDerWaalsContact O-OG1 3.07Å; I231-I378 HydrophobicContact CD1-CD1 4.14Å; I231-I378 HydrophobicContact CD1-CG1 4.43Å
232	K	92.5	Very high	89.7	Confident	141 Å²	141	85.2 Å²	85.2	61%	0.613	44%	0.438	S	S	*	.	H	α-helix	trans	-63.1	-42.3	-178.7	-71.6	175.5	-179.5	175.9	0	112.6	R228 Q229 D230 S236	R228-K232 WeakPolarHBondContact O-CG 3.3Å; R228-K232 PolarHBondContact O-N 2.98Å; Q229-K232 PolarHBondContact O-N 3.41Å; D230-K232 PolarHBondContact O-N 3.41Å; K232-S236 PolarHBondContact O-N 3.46Å; K232-S236 PolarHBondContact O-OG 2.88Å
233	L	92.2	Very high	90.2	Very high	103 Å²	103	86.3 Å²	86.3	54%	0.539	45%	0.445	S	S	.	.	H	α-helix	trans	-64	-44.1	177.8	-71.3	173.6	0	0	0	111.1	Q229 D230 I231 S236 S237	Q229-L233 HydrophobicContact CG-CD1 4.11Å; Q229-L233 HydrophobicContact CG-CG 4.47Å; Q229-L233 WeakPolarHBondContact O-CG 3.46Å; Q229-L233 PolarHBondContact O-N 3.43Å; D230-L233 PolarHBondContact O-N 3.42Å; I231-L233 PolarHBondContact O-N 2.85Å; L233-S236 PolarHBondContact O-N 3.45Å; L233-S237 WeakPolarHBondContact O-CB 3.18Å; L233-S237 PolarHBondContact O-N 3.25Å
234	R	90.9	Very high	90.6	Very high	104 Å²	104	87.1 Å²	87.1	39%	0.392	44%	0.443	S	S	.	.	H	α-helix	trans	-61.5	-47.1	177.6	-177.2	61.6	176.1	164.8	1.2	111.8	D230 I231 S236 S237 L238	D230-R234 WeakPolarHBondContact O-CB 3.45Å; D230-R234 PolarHBondContact O-N 3.48Å; I231-R234 PolarHBondContact O-N 3Å; R234-S236 PolarHBondContact O-N 3.12Å; R234-S237 PolarHBondContact O-N 3.37Å; R234-L238 HydrophobicContact CG-CD1 4.25Å; R234-L238 WeakPolarHBondContact O-CG 3.42Å; R234-L238 PolarHBondContact O-N 3.4Å
235	T	89.6	Confident	90.7	Very high	66 Å²	66	91.8 Å²	91.8	41%	0.405	46%	0.457	S	S	.	.	H	α-helix	trans	-60	-45.7	177.8	-58.3	0	0	0	0	111.7	I231 S237 L238 I239	I231-T235 PolarHBondContact O-N 2.93Å; I231-T235 PolarHBondContact O-OG1 3.11Å; I231-T235 VanDerWaalsContact O-OG1 3.07Å; T235-S237 PolarHBondContact O-N 2.81Å; T235-L238 PolarHBondContact O-N 3.49Å; T235-I239 HydrophobicContact CG2-CD1 3.92Å; T235-I239 WeakPolarHBondContact O-CG1 3.44Å; T235-I239 PolarHBondContact O-N 3.06Å
236	S	91.9	Very high	90.8	Very high	64 Å²	64	90.3 Å²	90.3	45%	0.448	46%	0.457	S	S	.	.	H	α-helix	trans	-61.5	-46.8	-180	-52.2	0	0	0	0	111.2	K232 L233 R234 L238 I239 D240	K232-S236 PolarHBondContact O-N 3.46Å; K232-S236 PolarHBondContact O-OG 2.88Å; L233-S236 PolarHBondContact O-N 3.45Å; R234-S236 PolarHBondContact O-N 3.12Å; S236-L238 VanDerWaalsContact C-N 3.31Å; S236-L238 PolarHBondContact O-N 3.27Å; S236-I239 PolarHBondContact O-N 3.29Å; S236-D240 VanDerWaalsContact O-CG 3.32Å; S236-D240 PolarHBondContact O-N 2.84Å
237	S	90.5	Very high	91.1	Very high	50 Å²	50	91.2 Å²	91.2	35%	0.35	46%	0.463	S	S	.	.	H	α-helix	trans	-60.2	-38.3	177	173.8	0	0	0	0	113.1	L233 R234 T235 C241	L233-S237 WeakPolarHBondContact O-CB 3.18Å; L233-S237 PolarHBondContact O-N 3.25Å; R234-S237 PolarHBondContact O-N 3.37Å; T235-S237 PolarHBondContact O-N 2.81Å; S237-C241 WeakPolarHBondContact O-CB 3.16Å; S237-C241 PolarHBondContact O-N 3.38Å; S237-C241 PolarHBondContact O-SG 3.26Å
238	L	88.6	Confident	91.3	Very high	46 Å²	46	92.4 Å²	92.4	24%	0.241	47%	0.468	C	S	.	.	H	α-helix	trans	-69.4	-40.5	177.7	-74.3	173.3	0	0	0	112.4	R234 T235 S236 D240 C241 I242 S375	R234-L238 HydrophobicContact CG-CD1 4.25Å; R234-L238 WeakPolarHBondContact O-CG 3.42Å; R234-L238 PolarHBondContact O-N 3.4Å; T235-L238 PolarHBondContact O-N 3.49Å; S236-L238 VanDerWaalsContact C-N 3.31Å; S236-L238 PolarHBondContact O-N 3.27Å; L238-D240 VanDerWaalsContact C-N 3.33Å; L238-C241 PolarHBondContact O-N 3.23Å; L238-I242 VanDerWaalsContact O-CG1 3.26Å; L238-I242 WeakPolarHBondContact O-CG1 3.08Å; L238-I242 PolarHBondContact O-N 3.39Å; L238-S375 WeakPolarHBondContact CD1-OG 3.37Å
239	I	90.3	Very high	91.1	Very high	80 Å²	80	88.9 Å²	88.9	41%	0.41	46%	0.459	S	S	.	.	H	α-helix	trans	-59.3	-47.8	175.3	-69.5	167.9	0	0	0	110	T235 S236 C241 I242 Q243	T235-I239 HydrophobicContact CG2-CD1 3.92Å; T235-I239 WeakPolarHBondContact O-CG1 3.44Å; T235-I239 PolarHBondContact O-N 3.06Å; S236-I239 PolarHBondContact O-N 3.29Å; I239-C241 VanDerWaalsContact C-N 3.34Å; I239-C241 PolarHBondContact O-N 3.26Å; I239-I242 PolarHBondContact O-N 3.26Å; I239-Q243 HydrophobicContact CG2-CG 4.32Å; I239-Q243 WeakPolarHBondContact O-CB 3.44Å; I239-Q243 WeakPolarHBondContact O-CG 3Å; I239-Q243 PolarHBondContact O-N 3.35Å
240	D	91.8	Very high	91.2	Very high	87 Å²	87	87.8 Å²	87.8	47%	0.465	46%	0.456	S	S	.	.	H	α-helix	trans	-60.5	-43.8	178.9	-64.7	-18.4	0	0	0	111.2	S236 L238 I242 Q243 N244	S236-D240 VanDerWaalsContact O-CG 3.32Å; S236-D240 PolarHBondContact O-N 2.84Å; L238-D240 VanDerWaalsContact C-N 3.33Å; D240-I242 PolarHBondContact O-N 3.01Å; D240-Q243 PolarHBondContact O-N 2.91Å; D240-N244 WeakPolarHBondContact O-CB 3.47Å; D240-N244 PolarHBondContact O-N 3.28Å; D240-N244 PolarHBondContact O-ND2 2.88Å; D240-N244 VanDerWaalsContact O-ND2 3.15Å
241	C	89.4	Confident	91.4	Very high	53 Å²	53	87.5 Å²	87.5	36%	0.358	46%	0.455	S	S	.	.	H	α-helix	trans	-61	-42	175.6	-75.5	0	0	0	0	112.8	S237 L238 I239 R245	S237-C241 WeakPolarHBondContact O-CB 3.16Å; S237-C241 PolarHBondContact O-N 3.38Å; S237-C241 PolarHBondContact O-SG 3.26Å; L238-C241 PolarHBondContact O-N 3.23Å; I239-C241 VanDerWaalsContact C-N 3.34Å; I239-C241 PolarHBondContact O-N 3.26Å; C241-R245 WeakPolarHBondContact O-CB 3.27Å; C241-R245 PolarHBondContact O-N 2.91Å
242	I	88.6	Confident	91.5	Very high	118 Å²	118	88.1 Å²	88.1	61%	0.605	46%	0.456	S	S	*	.	H	α-helix	trans	-66.9	-44.4	178.5	-69.9	165.9	0	0	0	110.5	L238 I239 D240 R245 S246	L238-I242 VanDerWaalsContact O-CG1 3.26Å; L238-I242 WeakPolarHBondContact O-CG1 3.08Å; L238-I242 PolarHBondContact O-N 3.39Å; I239-I242 PolarHBondContact O-N 3.26Å; D240-I242 PolarHBondContact O-N 3.01Å; I242-R245 PolarHBondContact O-N 2.8Å; I242-S246 WeakPolarHBondContact O-CB 3.39Å; I242-S246 PolarHBondContact O-N 3.26Å
243	Q	93.6	Very high	91.4	Very high	117 Å²	117	85.7 Å²	85.7	55%	0.547	45%	0.449	S	S	.	.	H	α-helix	trans	-62.2	-48.4	178.3	-73.1	177	-8.2	0	0	111.4	I239 D240 R245 S246 E247	I239-Q243 HydrophobicContact CG2-CG 4.32Å; I239-Q243 WeakPolarHBondContact O-CB 3.44Å; I239-Q243 WeakPolarHBondContact O-CG 3Å; I239-Q243 PolarHBondContact O-N 3.35Å; D240-Q243 PolarHBondContact O-N 2.91Å; Q243-R245 VanDerWaalsContact C-N 3.31Å; Q243-R245 PolarHBondContact O-N 3Å; Q243-S246 WeakPolarHBondContact O-CB 3.18Å; Q243-S246 PolarHBondContact O-N 3.13Å; Q243-S246 VanDerWaalsContact O-N 3.15Å; Q243-E247 PolarHBondContact O-N 2.89Å
244	N	92.1	Very high	91.5	Very high	93 Å²	93	85 Å²	85	50%	0.497	45%	0.446	S	S	.	.	H	α-helix	trans	-59.7	-41.4	176.1	-70.8	-25.4	0	0	0	111.7	D240 S246 E247 C248	D240-N244 WeakPolarHBondContact O-CB 3.47Å; D240-N244 PolarHBondContact O-N 3.28Å; D240-N244 PolarHBondContact O-ND2 2.88Å; D240-N244 VanDerWaalsContact O-ND2 3.15Å; N244-S246 VanDerWaalsContact C-N 3.35Å; N244-E247 PolarHBondContact O-N 2.88Å; N244-C248 PolarHBondContact O-N 3.46Å; N244-C248 PolarHBondContact O-SG 2.78Å; N244-C248 VanDerWaalsContact O-SG 3.37Å
245	R	90.4	Very high	91.6	Very high	133 Å²	133	86.1 Å²	86.1	50%	0.502	45%	0.454	S	S	.	.	H	α-helix	trans	-65.6	-39.7	177.2	-177.3	54.6	176.2	154.6	-1.3	111.7	C241 I242 Q243 C248 L249 E252	C241-R245 WeakPolarHBondContact O-CB 3.27Å; C241-R245 PolarHBondContact O-N 2.91Å; I242-R245 PolarHBondContact O-N 2.8Å; Q243-R245 VanDerWaalsContact C-N 3.31Å; Q243-R245 PolarHBondContact O-N 3Å; R245-C248 PolarHBondContact O-N 3Å; R245-L249 HydrophobicContact CG-CD1 4.21Å; R245-L249 WeakPolarHBondContact O-CG 3.45Å; R245-L249 PolarHBondContact O-N 3.27Å; R245-E252 IonicContact NH1-OE1 3.97Å
246	S	90.6	Very high	91.5	Very high	63 Å²	63	90 Å²	90	44%	0.441	47%	0.465	S	S	.	.	H	α-helix	trans	-60.1	-46.4	175.5	-173.2	0	0	0	0	111.3	I242 Q243 N244 L249 L250	I242-S246 WeakPolarHBondContact O-CB 3.39Å; I242-S246 PolarHBondContact O-N 3.26Å; Q243-S246 WeakPolarHBondContact O-CB 3.18Å; Q243-S246 PolarHBondContact O-N 3.13Å; Q243-S246 VanDerWaalsContact O-N 3.15Å; N244-S246 VanDerWaalsContact C-N 3.35Å; S246-L249 PolarHBondContact O-N 3.22Å; S246-L250 VanDerWaalsContact O-CG 3.31Å; S246-L250 WeakPolarHBondContact O-CG 3.4Å; S246-L250 PolarHBondContact O-N 3.33Å
247	E	94.7	Very high	91.4	Very high	133 Å²	133	88.8 Å²	88.8	62%	0.621	46%	0.459	S	S	*	.	H	α-helix	trans	-62.7	-45.1	178.3	-172.9	179.3	-177.5	0	0	112	Q243 N244 L249 L250 N251	Q243-E247 PolarHBondContact O-N 2.89Å; N244-E247 PolarHBondContact O-N 2.88Å; E247-L249 VanDerWaalsContact C-N 3.33Å; E247-L249 PolarHBondContact O-N 3Å; E247-L250 PolarHBondContact O-N 3.19Å; E247-N251 WeakPolarHBondContact O-CB 3.48Å; E247-N251 PolarHBondContact O-N 2.94Å
248	C	94.2	Very high	91.6	Very high	64 Å²	64	91.7 Å²	91.7	43%	0.432	47%	0.471	S	S	.	.	H	α-helix	trans	-58.3	-44.1	175.7	-73.8	0	0	0	0	112.3	N244 R245 N251 E252	N244-C248 PolarHBondContact O-N 3.46Å; N244-C248 PolarHBondContact O-SG 2.78Å; N244-C248 VanDerWaalsContact O-SG 3.37Å; R245-C248 PolarHBondContact O-N 3Å; C248-N251 PolarHBondContact O-N 3.09Å; C248-E252 WeakPolarHBondContact O-CB 3.04Å; C248-E252 WeakPolarHBondContact O-CG 3.29Å; C248-E252 PolarHBondContact O-N 3.36Å
249	L	89.5	Confident	91.6	Very high	66 Å²	66	92.1 Å²	92.1	35%	0.346	48%	0.481	S	S	.	.	H	α-helix	trans	-65.9	-39.9	179.1	-75.7	173.7	0	0	0	112.5	R245 S246 E247 E252 L253	R245-L249 HydrophobicContact CG-CD1 4.21Å; R245-L249 WeakPolarHBondContact O-CG 3.45Å; R245-L249 PolarHBondContact O-N 3.27Å; S246-L249 PolarHBondContact O-N 3.22Å; E247-L249 VanDerWaalsContact C-N 3.33Å; E247-L249 PolarHBondContact O-N 3Å; L249-E252 PolarHBondContact O-N 3.12Å; L249-L253 WeakPolarHBondContact O-CB 3.2Å; L249-L253 PolarHBondContact O-N 3.49Å
250	L	94.3	Very high	91.4	Very high	95 Å²	95	92.7 Å²	92.7	50%	0.497	48%	0.478	S	S	.	.	H	α-helix	trans	-63	-48	175.1	-71.2	168.9	0	0	0	110.8	S246 E247 E252 L253 D254	S246-L250 VanDerWaalsContact O-CG 3.31Å; S246-L250 WeakPolarHBondContact O-CG 3.4Å; S246-L250 PolarHBondContact O-N 3.33Å; E247-L250 PolarHBondContact O-N 3.19Å; L250-E252 VanDerWaalsContact C-N 3.34Å; L250-E252 PolarHBondContact O-N 3.03Å; L250-L253 WeakPolarHBondContact O-CB 3.43Å; L250-L253 PolarHBondContact O-N 3.38Å; L250-L253 VanDerWaalsContact O-N 3.13Å; L250-D254 VanDerWaalsContact O-CG 3.26Å; L250-D254 PolarHBondContact O-N 3.48Å
251	N	93.8	Very high	91.4	Very high	77 Å²	77	92.7 Å²	92.7	41%	0.412	48%	0.478	S	S	.	.	H	α-helix	trans	-63.1	-38.3	178.2	-172.7	28.7	0	0	0	112.7	E247 C248 K255	E247-N251 WeakPolarHBondContact O-CB 3.48Å; E247-N251 PolarHBondContact O-N 2.94Å; C248-N251 PolarHBondContact O-N 3.09Å; N251-K255 PolarHBondContact ND2-NZ 2.84Å; N251-K255 VanDerWaalsContact ND2-NZ 3.1Å; N251-K255 WeakPolarHBondContact O-CB 3.37Å; N251-K255 WeakPolarHBondContact O-CD 3.41Å; N251-K255 WeakPolarHBondContact O-CG 3.34Å; N251-K255 PolarHBondContact O-N 3.05Å; N251-K255 VanDerWaalsContact OD1-CE 3.25Å; N251-K255 WeakPolarHBondContact OD1-CE 3.28Å
252	E	91.2	Very high	91.6	Very high	97 Å²	97	91.3 Å²	91.3	45%	0.453	47%	0.472	S	S	.	.	H	α-helix	trans	-64.4	-40.4	173.6	-77.3	175.6	-152.1	0	0	112.1	R245 C248 L249 L250 K256	R245-E252 IonicContact NH1-OE1 3.97Å; C248-E252 WeakPolarHBondContact O-CB 3.04Å; C248-E252 WeakPolarHBondContact O-CG 3.29Å; C248-E252 PolarHBondContact O-N 3.36Å; L249-E252 PolarHBondContact O-N 3.12Å; L250-E252 VanDerWaalsContact C-N 3.34Å; L250-E252 PolarHBondContact O-N 3.03Å; E252-K256 WeakPolarHBondContact O-CG 3.49Å; E252-K256 PolarHBondContact O-N 2.91Å; E252-K256 VanDerWaalsContact O-N 3.16Å
253	L	91.3	Very high	91.6	Very high	91 Å²	91	89.2 Å²	89.2	48%	0.476	46%	0.457	S	S	.	.	H	α-helix	trans	-64.7	-49.2	176.7	178.3	62.7	0	0	0	110.9	L249 L250 K256 A257 A360	L249-L253 WeakPolarHBondContact O-CB 3.2Å; L249-L253 PolarHBondContact O-N 3.49Å; L250-L253 WeakPolarHBondContact O-CB 3.43Å; L250-L253 PolarHBondContact O-N 3.38Å; L250-L253 VanDerWaalsContact O-N 3.13Å; L253-K256 PolarHBondContact O-N 2.77Å; L253-A257 WeakPolarHBondContact O-CB 3.41Å; L253-A257 PolarHBondContact O-N 2.92Å; L253-A360 HydrophobicContact CD1-CB 4.08Å
254	D	94.1	Very high	91.5	Very high	89 Å²	89	86.2 Å²	86.2	48%	0.476	44%	0.444	S	S	.	.	H	α-helix	trans	-60.9	-48	-179.5	-68.5	-23	0	0	0	110.7	L250 K256 A257 D258	L250-D254 VanDerWaalsContact O-CG 3.26Å; L250-D254 PolarHBondContact O-N 3.48Å; D254-K256 VanDerWaalsContact C-N 3.31Å; D254-K256 PolarHBondContact O-N 2.9Å; D254-A257 WeakPolarHBondContact O-CB 3.36Å; D254-A257 PolarHBondContact O-N 3.27Å; D254-A257 VanDerWaalsContact O-N 3.12Å; D254-D258 WeakPolarHBondContact O-CB 3.44Å; D254-D258 PolarHBondContact O-N 3.49Å
255	K	93.4	Very high	91.5	Very high	126 Å²	126	86.9 Å²	86.9	55%	0.548	44%	0.444	S	S	.	.	H	α-helix	trans	-56.6	-42.9	175.8	-76.6	170.1	177.5	166.9	0	113	N251 A259	N251-K255 PolarHBondContact ND2-NZ 2.84Å; N251-K255 VanDerWaalsContact ND2-NZ 3.1Å; N251-K255 WeakPolarHBondContact O-CB 3.37Å; N251-K255 WeakPolarHBondContact O-CD 3.41Å; N251-K255 WeakPolarHBondContact O-CG 3.34Å; N251-K255 PolarHBondContact O-N 3.05Å; N251-K255 VanDerWaalsContact OD1-CE 3.25Å; N251-K255 WeakPolarHBondContact OD1-CE 3.28Å; K255-A259 WeakPolarHBondContact O-CB 3.46Å; K255-A259 PolarHBondContact O-N 3.29Å; K255-A259 VanDerWaalsContact O-N 3.12Å
256	K	87.4	Confident	91.5	Very high	147 Å²	147	84.8 Å²	84.8	64%	0.639	44%	0.44	S	S	*	.	H	α-helix	trans	-69.7	-39.7	177.8	-78.6	-175.1	177.6	177.4	0	111.6	E252 L253 D254 Y260	E252-K256 WeakPolarHBondContact O-CG 3.49Å; E252-K256 PolarHBondContact O-N 2.91Å; E252-K256 VanDerWaalsContact O-N 3.16Å; L253-K256 PolarHBondContact O-N 2.77Å; D254-K256 VanDerWaalsContact C-N 3.31Å; D254-K256 PolarHBondContact O-N 2.9Å; K256-Y260 WeakPolarHBondContact O-CB 3.23Å; K256-Y260 WeakPolarHBondContact O-CD2 3.15Å; K256-Y260 PolarHBondContact O-N 3.27Å
257	A	89.7	Confident	91.5	Very high	39 Å²	39	82 Å²	82	32%	0.322	42%	0.421	S	S	.	.	H	α-helix	trans	-62.1	-49.7	176.7	0	0	0	0	0	110.8	L253 D254 A259 Y260 I261	L253-A257 WeakPolarHBondContact O-CB 3.41Å; L253-A257 PolarHBondContact O-N 2.92Å; D254-A257 WeakPolarHBondContact O-CB 3.36Å; D254-A257 PolarHBondContact O-N 3.27Å; D254-A257 VanDerWaalsContact O-N 3.12Å; A257-A259 PolarHBondContact O-N 3.31Å; A257-Y260 PolarHBondContact O-N 2.92Å; A257-Y260 VanDerWaalsContact O-N 3.1Å; A257-I261 WeakPolarHBondContact O-CB 3.36Å; A257-I261 VanDerWaalsContact O-CG1 3.29Å; A257-I261 WeakPolarHBondContact O-CG1 3.49Å; A257-I261 PolarHBondContact O-N 2.84Å
258	D	93.8	Very high	91.4	Very high	111 Å²	111	81 Å²	81	59%	0.594	42%	0.416	S	S	*	.	H	α-helix	trans	-59.8	-44.4	178.8	-72.2	-21.4	0	0	0	111.9	D254 Y260 I261 G262	D254-D258 WeakPolarHBondContact O-CB 3.44Å; D254-D258 PolarHBondContact O-N 3.49Å; D258-Y260 VanDerWaalsContact C-N 3.31Å; D258-Y260 PolarHBondContact O-N 3.44Å; D258-I261 PolarHBondContact O-N 3.19Å; D258-G262 PolarHBondContact O-N 3.28Å
259	A	89.5	Confident	91.3	Very high	55 Å²	55	81 Å²	81	46%	0.455	41%	0.411	S	S	.	.	H	α-helix	trans	-62.9	-36.6	176.1	0	0	0	0	0	112.6	K255 A257 R263	K255-A259 WeakPolarHBondContact O-CB 3.46Å; K255-A259 PolarHBondContact O-N 3.29Å; K255-A259 VanDerWaalsContact O-N 3.12Å; A257-A259 PolarHBondContact O-N 3.31Å; A259-R263 WeakPolarHBondContact O-CG 3.25Å; A259-R263 PolarHBondContact O-N 3.32Å
260	Y	86.9	Confident	91.3	Very high	92 Å²	92	78.5 Å²	78.5	36%	0.361	40%	0.399	S	S	.	.	H	α-helix	trans	-72.2	-44.5	177	-90.2	-131.7	0	0	0	111.6	K256 A257 D258 R263 L264 M355 T358	K256-Y260 WeakPolarHBondContact O-CB 3.23Å; K256-Y260 WeakPolarHBondContact O-CD2 3.15Å; K256-Y260 PolarHBondContact O-N 3.27Å; A257-Y260 PolarHBondContact O-N 2.92Å; A257-Y260 VanDerWaalsContact O-N 3.1Å; D258-Y260 VanDerWaalsContact C-N 3.31Å; D258-Y260 PolarHBondContact O-N 3.44Å; Y260-R263 VanDerWaalsContact CE2-NH2 3.27Å; Y260-R263 PolarHBondContact O-N 2.92Å; Y260-L264 WeakPolarHBondContact O-CG 3.26Å; Y260-L264 PolarHBondContact O-N 2.94Å; Y260-M355 HydrophobicContact CD1-CB 4.2Å; Y260-M355 HydrophobicContact CD1-CE 4.26Å; Y260-M355 HydrophobicContact CD1-CG 4.11Å; Y260-M355 HydrophobicContact CE1-CB 4.33Å; Y260-M355 HydrophobicContact CE1-CG 3.99Å; Y260-M355 HydrophobicContact CG-CE 4.12Å; Y260-M355 WeakPolarHBondContact O-CE 3.39Å; Y260-T358 HydrophobicContact CE1-CG2 3.95Å
261	I	91.9	Very high	91.2	Very high	87 Å²	87	76.3 Å²	76.3	45%	0.446	39%	0.387	S	S	.	.	H	α-helix	trans	-61.1	-47	177.2	-69.3	166.8	0	0	0	110.1	A257 D258 R263 L264 Q265	A257-I261 WeakPolarHBondContact O-CB 3.36Å; A257-I261 VanDerWaalsContact O-CG1 3.29Å; A257-I261 WeakPolarHBondContact O-CG1 3.49Å; A257-I261 PolarHBondContact O-N 2.84Å; D258-I261 PolarHBondContact O-N 3.19Å; I261-R263 PolarHBondContact O-N 2.89Å; I261-L264 PolarHBondContact O-N 2.89Å; I261-Q265 HydrophobicContact CG2-CG 4.45Å; I261-Q265 WeakPolarHBondContact O-CG 3.44Å; I261-Q265 PolarHBondContact O-N 2.87Å
262	G	91.8	Very high	91.3	Very high	24 Å²	24	77.7 Å²	77.7	25%	0.247	39%	0.386	C	S	.	.	H	α-helix	trans	-58.5	-47.2	178.9	0	0	0	0	0	112.6	D258 L264 Q265 E266	D258-G262 PolarHBondContact O-N 3.28Å; G262-L264 PolarHBondContact O-N 3.05Å; G262-Q265 WeakPolarHBondContact O-CB 3.5Å; G262-Q265 PolarHBondContact O-N 3.19Å; G262-E266 WeakPolarHBondContact O-CG 3.37Å; G262-E266 PolarHBondContact O-N 3.36Å
263	R	89.5	Confident	91.4	Very high	75 Å²	75	78.1 Å²	78.1	28%	0.283	39%	0.387	S	S	.	.	H	α-helix	trans	-63.8	-39.5	175.8	-77.7	-166.3	-58.9	153.8	2.5	112.9	A259 Y260 I261 Q265 E266 T267 M355	A259-R263 WeakPolarHBondContact O-CG 3.25Å; A259-R263 PolarHBondContact O-N 3.32Å; Y260-R263 VanDerWaalsContact CE2-NH2 3.27Å; Y260-R263 PolarHBondContact O-N 2.92Å; I261-R263 PolarHBondContact O-N 2.89Å; R263-Q265 VanDerWaalsContact C-N 3.33Å; R263-Q265 PolarHBondContact O-N 3Å; R263-E266 PolarHBondContact O-N 3.31Å; R263-T267 PolarHBondContact O-N 3.09Å; R263-T267 PolarHBondContact O-OG1 3.21Å; R263-M355 HydrophobicContact CB-CE 3.35Å; R263-M355 HydrophobicContact CB-SD 4.16Å; R263-M355 HydrophobicContact CG-CE 4.38Å; R263-M355 PolarHBondContact NH1-SD 3.23Å; R263-M355 PolarHBondContact NH2-SD 2.89Å
264	L	91.1	Very high	91.4	Very high	54 Å²	54	74.3 Å²	74.3	28%	0.283	37%	0.367	S	S	.	.	H	α-helix	trans	-63.8	-39	175.4	-73.2	175.2	0	0	0	111.8	Y260 I261 G262 T267 E268 M355 V356	Y260-L264 WeakPolarHBondContact O-CG 3.26Å; Y260-L264 PolarHBondContact O-N 2.94Å; I261-L264 PolarHBondContact O-N 2.89Å; G262-L264 PolarHBondContact O-N 3.05Å; L264-T267 PolarHBondContact O-N 3.5Å; L264-E268 WeakPolarHBondContact O-CB 3.43Å; L264-E268 PolarHBondContact O-N 3.19Å; L264-M355 HydrophobicContact CD2-CB 3.99Å; L264-M355 HydrophobicContact CD2-CE 4.16Å; L264-M355 HydrophobicContact CG-CB 4.46Å; L264-M355 HydrophobicContact CG-CE 3.82Å; L264-V356 HydrophobicContact CD2-CG2 3.63Å
265	Q	92.9	Very high	91.4	Very high	107 Å²	107	75.5 Å²	75.5	50%	0.5	37%	0.369	S	S	.	.	H	α-helix	trans	-65	-40.3	174	-72.1	174.6	-17.5	0	0	112	I261 G262 R263 E268 N269	I261-Q265 HydrophobicContact CG2-CG 4.45Å; I261-Q265 WeakPolarHBondContact O-CG 3.44Å; I261-Q265 PolarHBondContact O-N 2.87Å; G262-Q265 WeakPolarHBondContact O-CB 3.5Å; G262-Q265 PolarHBondContact O-N 3.19Å; R263-Q265 VanDerWaalsContact C-N 3.33Å; R263-Q265 PolarHBondContact O-N 3Å; Q265-E268 PolarHBondContact O-N 2.99Å; Q265-N269 WeakPolarHBondContact O-CB 3.46Å; Q265-N269 PolarHBondContact O-N 2.86Å; Q265-N269 PolarHBondContact O-ND2 3.45Å
266	E	90.6	Very high	91.5	Very high	89 Å²	89	75 Å²	75	42%	0.416	37%	0.369	S	S	.	.	H	α-helix	trans	-59.4	-47.3	173.1	-74.4	178.6	-163.2	0	0	111.4	G262 R263 N269 L270 N348	G262-E266 WeakPolarHBondContact O-CG 3.37Å; G262-E266 PolarHBondContact O-N 3.36Å; R263-E266 PolarHBondContact O-N 3.31Å; E266-N269 PolarHBondContact O-N 3.1Å; E266-L270 PolarHBondContact O-N 2.86Å; E266-N348 WeakPolarHBondContact OE2-CB 3.45Å; E266-N348 PolarHBondContact OE2-ND2 3.39Å
267	T	90	Very high	91.9	Very high	4 Å²	4	71 Å²	71	3%	0.025	35%	0.352	C	S	.	.	H	α-helix	trans	-61.6	-45.9	175.7	-62.6	0	0	0	0	112.1	R263 L264 N269 L270 I271 V349 W352	R263-T267 PolarHBondContact O-N 3.09Å; R263-T267 PolarHBondContact O-OG1 3.21Å; L264-T267 PolarHBondContact O-N 3.5Å; T267-N269 VanDerWaalsContact C-N 3.32Å; T267-N269 PolarHBondContact O-N 3.23Å; T267-L270 PolarHBondContact O-N 2.9Å; T267-L270 VanDerWaalsContact O-N 3.17Å; T267-I271 HydrophobicContact CG2-CD1 3.75Å; T267-I271 HydrophobicContact CG2-CG1 4.36Å; T267-I271 WeakPolarHBondContact O-CG1 3.39Å; T267-I271 PolarHBondContact O-N 3.06Å; T267-V349 HydrophobicContact CG2-CG1 3.68Å; T267-W352 HydrophobicContact CG2-CB 3.87Å; T267-W352 HydrophobicContact CG2-CD2 4.22Å; T267-W352 HydrophobicContact CG2-CG 3.84Å
268	E	91.9	Very high	92.1	Very high	112 Å²	112	72 Å²	72	52%	0.523	35%	0.352	S	S	.	.	H	α-helix	trans	-57.2	-46.8	176.6	-173	-162.1	145.3	0	0	111.1	L264 Q265 L270 I271 R272	L264-E268 WeakPolarHBondContact O-CB 3.43Å; L264-E268 PolarHBondContact O-N 3.19Å; Q265-E268 PolarHBondContact O-N 2.99Å; E268-L270 VanDerWaalsContact C-N 3.32Å; E268-L270 PolarHBondContact O-N 3.38Å; E268-I271 PolarHBondContact O-N 3.17Å; E268-R272 WeakPolarHBondContact O-CB 3.17Å; E268-R272 PolarHBondContact O-N 2.99Å; E268-R272 IonicContact OE1-NH1 3.58Å
269	N	92.2	Very high	92.3	Very high	63 Å²	63	72 Å²	72	34%	0.337	35%	0.352	S	S	.	.	H	α-helix	trans	-62.6	-38.2	178	-72	-35.5	0	0	0	112.1	Q265 E266 T267 R272 K273	Q265-N269 WeakPolarHBondContact O-CB 3.46Å; Q265-N269 PolarHBondContact O-N 2.86Å; Q265-N269 PolarHBondContact O-ND2 3.45Å; E266-N269 PolarHBondContact O-N 3.1Å; T267-N269 VanDerWaalsContact C-N 3.32Å; T267-N269 PolarHBondContact O-N 3.23Å; N269-R272 PolarHBondContact OD1-NH1 3.33Å; N269-R272 PolarHBondContact OD1-NH2 2.89Å; N269-K273 WeakPolarHBondContact O-CG 3.42Å; N269-K273 PolarHBondContact O-N 3.06Å; N269-K273 VanDerWaalsContact O-N 3.11Å
270	L	91.1	Very high	92.6	Very high	15 Å²	15	76.4 Å²	76.4	8%	0.079	36%	0.361	C	S	.	.	H	α-helix	trans	-67.2	-47.5	177.3	-166.7	67.9	0	0	0	111.6	E266 T267 E268 R272 K273 L274 I320 L344 V349	E266-L270 PolarHBondContact O-N 2.86Å; T267-L270 PolarHBondContact O-N 2.9Å; T267-L270 VanDerWaalsContact O-N 3.17Å; E268-L270 VanDerWaalsContact C-N 3.32Å; E268-L270 PolarHBondContact O-N 3.38Å; L270-R272 VanDerWaalsContact C-N 3.3Å; L270-R272 PolarHBondContact O-N 3.17Å; L270-K273 PolarHBondContact O-N 2.98Å; L270-L274 WeakPolarHBondContact O-CB 3.33Å; L270-L274 PolarHBondContact O-N 3.17Å; L270-I320 HydrophobicContact CD2-CD1 3.8Å; L270-I320 HydrophobicContact CD2-CG1 4.48Å; L270-I320 HydrophobicContact CG-CD1 4.14Å; L270-L344 VanDerWaalsContact CD1-C 3.5Å; L270-L344 WeakPolarHBondContact CD1-O 3.45Å; L270-L344 WeakPolarHBondContact CD2-O 3.08Å; L270-V349 HydrophobicContact CB-CG2 4.43Å; L270-V349 HydrophobicContact CD2-CB 4.3Å; L270-V349 HydrophobicContact CD2-CG1 4.39Å; L270-V349 HydrophobicContact CD2-CG2 3.59Å
271	I	91.9	Very high	93	Very high	49 Å²	49	72.5 Å²	72.5	25%	0.251	35%	0.348	S	S	.	.	H	α-helix	trans	-58.3	-45.3	177.5	-69.7	169.5	0	0	0	110.1	T267 E268 L274 Q275 I320	T267-I271 HydrophobicContact CG2-CD1 3.75Å; T267-I271 HydrophobicContact CG2-CG1 4.36Å; T267-I271 WeakPolarHBondContact O-CG1 3.39Å; T267-I271 PolarHBondContact O-N 3.06Å; E268-I271 PolarHBondContact O-N 3.17Å; I271-L274 PolarHBondContact O-N 3.26Å; I271-Q275 HydrophobicContact CG2-CG 4.45Å; I271-Q275 WeakPolarHBondContact O-CG 3.42Å; I271-Q275 PolarHBondContact O-N 3.39Å; I271-I320 HydrophobicContact CD1-CG2 4.32Å; I271-I320 HydrophobicContact CG1-CG2 3.98Å
272	R	94.6	Very high	93.2	Very high	105 Å²	105	71 Å²	71	40%	0.396	35%	0.345	S	S	.	.	H	α-helix	trans	-60.1	-48.1	177.8	-173.2	171	65.8	-123.9	-2.6	112.1	E268 N269 L270 L274 Q275 E276	E268-R272 WeakPolarHBondContact O-CB 3.17Å; E268-R272 PolarHBondContact O-N 2.99Å; E268-R272 IonicContact OE1-NH1 3.58Å; N269-R272 PolarHBondContact OD1-NH1 3.33Å; N269-R272 PolarHBondContact OD1-NH2 2.89Å; L270-R272 VanDerWaalsContact C-N 3.3Å; L270-R272 PolarHBondContact O-N 3.17Å; R272-L274 VanDerWaalsContact C-N 3.33Å; R272-L274 PolarHBondContact O-N 2.87Å; R272-Q275 PolarHBondContact O-N 3.06Å; R272-E276 WeakPolarHBondContact O-CG 3.27Å; R272-E276 PolarHBondContact O-N 3.09Å
273	K	93.2	Very high	93.4	Very high	107 Å²	107	72.7 Å²	72.7	47%	0.465	36%	0.356	S	S	.	.	H	α-helix	trans	-60.8	-41.3	176.4	-74.7	174.4	-178.6	176	0	112.1	N269 L270 E276 Q277 L344	N269-K273 WeakPolarHBondContact O-CG 3.42Å; N269-K273 PolarHBondContact O-N 3.06Å; N269-K273 VanDerWaalsContact O-N 3.11Å; L270-K273 PolarHBondContact O-N 2.98Å; K273-E276 PolarHBondContact O-N 2.95Å; K273-Q277 WeakPolarHBondContact O-CG 3.29Å; K273-Q277 PolarHBondContact O-N 3.5Å; K273-Q277 VanDerWaalsContact O-N 3.13Å; K273-L344 HydrophobicContact CB-CD2 4.33Å
274	L	92.1	Very high	93.7	Very high	10 Å²	10	73.2 Å²	73.2	5%	0.052	36%	0.361	C	S	.	.	H	α-helix	trans	-65.5	-43.2	178.7	-175.9	62.7	0	0	0	111.2	L270 I271 R272 E276 Q277 I278 L313 L316 I320 L344	L270-L274 WeakPolarHBondContact O-CB 3.33Å; L270-L274 PolarHBondContact O-N 3.17Å; I271-L274 PolarHBondContact O-N 3.26Å; R272-L274 VanDerWaalsContact C-N 3.33Å; R272-L274 PolarHBondContact O-N 2.87Å; L274-E276 PolarHBondContact O-N 2.83Å; L274-Q277 PolarHBondContact O-N 2.93Å; L274-I278 HydrophobicContact CD1-CD1 4.33Å; L274-I278 HydrophobicContact CD1-CG1 4.49Å; L274-I278 HydrophobicContact CG-CD1 3.92Å; L274-I278 HydrophobicContact CG-CG1 4.49Å; L274-I278 WeakPolarHBondContact O-CG1 3.5Å; L274-I278 PolarHBondContact O-N 3.44Å; L274-L313 HydrophobicContact CD1-CD2 3.73Å; L274-L316 HydrophobicContact CD1-CB 4.24Å; L274-L316 HydrophobicContact CD2-CB 4.49Å; L274-I320 HydrophobicContact CD2-CD1 3.66Å; L274-L344 HydrophobicContact CD1-CD1 4.32Å
275	Q	94.6	Very high	93.9	Very high	114 Å²	114	71.3 Å²	71.3	53%	0.533	35%	0.352	S	S	.	.	H	α-helix	trans	-59.3	-45.2	175.1	-75.9	179.1	-20.9	0	0	112.4	I271 R272 Q277 I278 N279	I271-Q275 HydrophobicContact CG2-CG 4.45Å; I271-Q275 WeakPolarHBondContact O-CG 3.42Å; I271-Q275 PolarHBondContact O-N 3.39Å; R272-Q275 PolarHBondContact O-N 3.06Å; Q275-Q277 VanDerWaalsContact C-N 3.3Å; Q275-Q277 PolarHBondContact O-N 3.46Å; Q275-I278 PolarHBondContact O-N 3.29Å; Q275-N279 WeakPolarHBondContact O-CB 3.26Å; Q275-N279 PolarHBondContact O-N 3.41Å; Q275-N279 PolarHBondContact O-ND2 3.42Å
276	E	95.5	Very high	94	Very high	115 Å²	115	69.8 Å²	69.8	54%	0.537	35%	0.348	S	S	.	.	H	α-helix	trans	-58.1	-43.1	176	-72.9	169.4	-171.7	0	0	111.8	R272 K273 L274 N279 F280	R272-E276 WeakPolarHBondContact O-CG 3.27Å; R272-E276 PolarHBondContact O-N 3.09Å; K273-E276 PolarHBondContact O-N 2.95Å; L274-E276 PolarHBondContact O-N 2.83Å; E276-N279 PolarHBondContact O-N 3.3Å; E276-F280 PolarHBondContact O-N 2.67Å
277	Q	94.6	Very high	94.2	Very high	63 Å²	63	71.1 Å²	71.1	29%	0.294	35%	0.354	S	S	.	.	H	α-helix	trans	-72.4	-36	179.7	-69	-164.3	-0.7	0	0	113.7	K273 L274 Q275 A281 R309 L313	K273-Q277 WeakPolarHBondContact O-CG 3.29Å; K273-Q277 PolarHBondContact O-N 3.5Å; K273-Q277 VanDerWaalsContact O-N 3.13Å; L274-Q277 PolarHBondContact O-N 2.93Å; Q275-Q277 VanDerWaalsContact C-N 3.3Å; Q275-Q277 PolarHBondContact O-N 3.46Å; Q277-A281 VanDerWaalsContact O-CB 3.29Å; Q277-A281 WeakPolarHBondContact O-CB 3.33Å; Q277-A281 PolarHBondContact O-N 2.92Å; Q277-R309 VanDerWaalsContact CD-NH2 3.32Å; Q277-L313 HydrophobicContact CB-CD2 4.05Å
278	I	95.1	Very high	94.5	Very high	62 Å²	62	71.6 Å²	71.6	32%	0.318	36%	0.356	S	S	.	.	H	α-helix	trans	-61.4	-48	171.7	-71.9	168.1	0	0	0	110	L274 Q275 F280 A281 S282 L313	L274-I278 HydrophobicContact CD1-CD1 4.33Å; L274-I278 HydrophobicContact CD1-CG1 4.49Å; L274-I278 HydrophobicContact CG-CD1 3.92Å; L274-I278 HydrophobicContact CG-CG1 4.49Å; L274-I278 WeakPolarHBondContact O-CG1 3.5Å; L274-I278 PolarHBondContact O-N 3.44Å; Q275-I278 PolarHBondContact O-N 3.29Å; I278-F280 PolarHBondContact O-N 2.78Å; I278-A281 PolarHBondContact O-N 2.81Å; I278-S282 VanDerWaalsContact O-CB 3.25Å; I278-S282 WeakPolarHBondContact O-CB 3.33Å; I278-S282 PolarHBondContact O-N 2.9Å; I278-L313 HydrophobicContact CG1-CB 4.09Å; I278-L313 HydrophobicContact CG1-CD1 4.4Å; I278-L313 HydrophobicContact CG1-CD2 4.49Å
279	N	96.4	Very high	94.5	Very high	111 Å²	111	71.1 Å²	71.1	59%	0.594	36%	0.356	S	S	*	.	H	α-helix	trans	-60.3	-44.8	179.4	-70.9	-22.6	0	0	0	111.6	Q275 E276 A283	Q275-N279 WeakPolarHBondContact O-CB 3.26Å; Q275-N279 PolarHBondContact O-N 3.41Å; Q275-N279 PolarHBondContact O-ND2 3.42Å; E276-N279 PolarHBondContact O-N 3.3Å; N279-A283 WeakPolarHBondContact O-CB 3.5Å; N279-A283 PolarHBondContact O-N 2.87Å
280	F	96.8	Very high	94.6	Very high	147 Å²	147	75.5 Å²	75.5	65%	0.645	37%	0.374	S	S	*	.	H	α-helix	trans	-63.8	-48.9	176.6	179.9	-92.8	0	0	0	112.4	E276 I278 S282 A283 F284	E276-F280 PolarHBondContact O-N 2.67Å; I278-F280 PolarHBondContact O-N 2.78Å; F280-S282 VanDerWaalsContact C-N 3.31Å; F280-S282 PolarHBondContact O-N 3.4Å; F280-A283 PolarHBondContact O-N 3.14Å; F280-F284 WeakPolarHBondContact O-CB 3.4Å; F280-F284 PolarHBondContact O-N 2.83Å
281	A	95.3	Very high	94.7	Very high	9 Å²	9	77.1 Å²	77.1	7%	0.074	38%	0.383	C	S	.	.	H	α-helix	trans	-63	-39	-179.4	0	0	0	0	0	111.9	Q277 I278 S285 L310 L313	Q277-A281 VanDerWaalsContact O-CB 3.29Å; Q277-A281 WeakPolarHBondContact O-CB 3.33Å; Q277-A281 PolarHBondContact O-N 2.92Å; I278-A281 PolarHBondContact O-N 2.81Å; A281-S285 WeakPolarHBondContact O-CB 3.03Å; A281-S285 PolarHBondContact O-N 2.92Å; A281-S285 PolarHBondContact O-OG 3.27Å; A281-L310 HydrophobicContact CB-CD2 4.12Å; A281-L313 HydrophobicContact CB-CD1 3.56Å
282	S	96.1	Very high	94.7	Very high	55 Å²	55	77.2 Å²	77.2	39%	0.385	39%	0.386	S	S	.	.	H	α-helix	trans	-63.5	-48.6	173.9	-179.1	0	0	0	0	111.7	I278 F280 F284 S285 N286	I278-S282 VanDerWaalsContact O-CB 3.25Å; I278-S282 WeakPolarHBondContact O-CB 3.33Å; I278-S282 PolarHBondContact O-N 2.9Å; F280-S282 VanDerWaalsContact C-N 3.31Å; F280-S282 PolarHBondContact O-N 3.4Å; S282-F284 PolarHBondContact O-N 2.75Å; S282-S285 PolarHBondContact O-N 2.9Å; S282-N286 WeakPolarHBondContact O-CB 3.38Å; S282-N286 PolarHBondContact O-N 3.23Å; S282-N286 PolarHBondContact O-ND2 2.99Å; S282-N286 VanDerWaalsContact O-ND2 3.11Å
283	A	96.4	Very high	94.5	Very high	60 Å²	60	79.5 Å²	79.5	50%	0.496	41%	0.406	S	S	.	.	H	α-helix	trans	-60.8	-43.7	177.5	0	0	0	0	0	112.4	N279 F280 N286 H287	N279-A283 WeakPolarHBondContact O-CB 3.5Å; N279-A283 PolarHBondContact O-N 2.87Å; F280-A283 PolarHBondContact O-N 3.14Å; A283-N286 PolarHBondContact O-N 3.25Å; A283-H287 PolarHBondContact O-N 3.15Å
284	F	96.2	Very high	94.5	Very high	86 Å²	86	80.8 Å²	80.8	38%	0.377	42%	0.418	S	S	.	.	H	α-helix	trans	-62.3	-44.6	176.2	-175.8	-95.3	0	0	0	112	F280 S282 H287 L288 L302 V306	F280-F284 WeakPolarHBondContact O-CB 3.4Å; F280-F284 PolarHBondContact O-N 2.83Å; S282-F284 PolarHBondContact O-N 2.75Å; F284-H287 WeakPolarHBondContact O-CB 3.41Å; F284-H287 PolarHBondContact O-N 3.01Å; F284-L288 HydrophobicContact CD1-CD1 4.05Å; F284-L288 HydrophobicContact CE1-CD1 3.55Å; F284-L288 HydrophobicContact CE1-CG 4.17Å; F284-L288 HydrophobicContact CZ-CD1 4.22Å; F284-L288 PolarHBondContact O-N 3.27Å; F284-L288 VanDerWaalsContact O-N 3.1Å; F284-L302 HydrophobicContact CE1-CD1 4.46Å; F284-L302 HydrophobicContact CZ-CD1 4.08Å; F284-V306 HydrophobicContact CD1-CG2 4.07Å; F284-V306 HydrophobicContact CE1-CG2 3.72Å
285	S	95.4	Very high	94.5	Very high	14 Å²	14	83.1 Å²	83.1	10%	0.098	43%	0.43	C	S	.	.	H	α-helix	trans	-64.1	-44	178.4	-55.9	0	0	0	0	111.5	A281 S282 H287 L288 I289 V306	A281-S285 WeakPolarHBondContact O-CB 3.03Å; A281-S285 PolarHBondContact O-N 2.92Å; A281-S285 PolarHBondContact O-OG 3.27Å; S282-S285 PolarHBondContact O-N 2.9Å; S285-H287 VanDerWaalsContact C-N 3.31Å; S285-H287 PolarHBondContact O-N 3.28Å; S285-L288 PolarHBondContact O-N 3.32Å; S285-I289 WeakPolarHBondContact O-CG1 3.34Å; S285-I289 PolarHBondContact O-N 3.24Å; S285-V306 VanDerWaalsContact OG-CG1 3.22Å; S285-V306 WeakPolarHBondContact OG-CG1 3.47Å
286	N	95.1	Very high	94.3	Very high	76 Å²	76	81.2 Å²	81.2	41%	0.406	43%	0.427	S	S	.	.	H	α-helix	trans	-62	-38.5	175.3	-74.1	-36.8	0	0	0	112	S282 A283 I289 H290	S282-N286 WeakPolarHBondContact O-CB 3.38Å; S282-N286 PolarHBondContact O-N 3.23Å; S282-N286 PolarHBondContact O-ND2 2.99Å; S282-N286 VanDerWaalsContact O-ND2 3.11Å; A283-N286 PolarHBondContact O-N 3.25Å; N286-I289 PolarHBondContact O-N 3.08Å; N286-H290 WeakPolarHBondContact O-CB 3.38Å; N286-H290 PolarHBondContact O-CD2 3.25Å; N286-H290 PolarHBondContact O-N 3.14Å
287	H	94.7	Very high	94.2	Very high	117 Å²	117	78.7 Å²	78.7	54%	0.542	43%	0.427	S	S	.	.	H	α-helix	trans	-61.5	-44.4	175.1	-178.1	72	0	0	0	112	A283 F284 S285 I289 H290 N291	A283-H287 PolarHBondContact O-N 3.15Å; F284-H287 WeakPolarHBondContact O-CB 3.41Å; F284-H287 PolarHBondContact O-N 3.01Å; S285-H287 VanDerWaalsContact C-N 3.31Å; S285-H287 PolarHBondContact O-N 3.28Å; H287-I289 VanDerWaalsContact C-N 3.35Å; H287-I289 PolarHBondContact O-N 3.14Å; H287-H290 PolarHBondContact O-N 3.42Å; H287-N291 WeakPolarHBondContact O-CB 3.5Å; H287-N291 PolarHBondContact O-N 2.82Å
288	L	94.4	Very high	94.1	Very high	14 Å²	14	77.3 Å²	77.3	7%	0.073	42%	0.424	C	S	.	.	H	α-helix	trans	-62.3	-40.9	175.3	-68.5	176.8	0	0	0	112.2	F284 S285 N291 V292 L299 L302 V306	F284-L288 HydrophobicContact CD1-CD1 4.05Å; F284-L288 HydrophobicContact CE1-CD1 3.55Å; F284-L288 HydrophobicContact CE1-CG 4.17Å; F284-L288 HydrophobicContact CZ-CD1 4.22Å; F284-L288 PolarHBondContact O-N 3.27Å; F284-L288 VanDerWaalsContact O-N 3.1Å; S285-L288 PolarHBondContact O-N 3.32Å; L288-N291 PolarHBondContact O-N 3.27Å; L288-V292 WeakPolarHBondContact O-CG2 3.17Å; L288-V292 PolarHBondContact O-N 3.26Å; L288-L299 HydrophobicContact CB-CD1 4.07Å; L288-L302 HydrophobicContact CD1-CB 4.33Å; L288-L302 HydrophobicContact CD1-CD1 4.37Å; L288-L302 HydrophobicContact CD2-CD1 4.28Å; L288-V306 HydrophobicContact CD1-CG2 3.83Å
289	I	93.6	Very high	94.1	Very high	102 Å²	102	76.7 Å²	76.7	52%	0.523	42%	0.421	S	S	.	.	H	α-helix	trans	-65	-43.3	177.6	-66.9	165.1	0	0	0	111.3	S285 N286 H287 N291 V292	S285-I289 WeakPolarHBondContact O-CG1 3.34Å; S285-I289 PolarHBondContact O-N 3.24Å; N286-I289 PolarHBondContact O-N 3.08Å; H287-I289 VanDerWaalsContact C-N 3.35Å; H287-I289 PolarHBondContact O-N 3.14Å; I289-N291 VanDerWaalsContact C-N 3.27Å; I289-N291 PolarHBondContact O-N 2.99Å; I289-V292 WeakPolarHBondContact O-CG2 3.39Å; I289-V292 PolarHBondContact O-N 3.37Å
290	H	93.1	Very high	93.9	Very high	155 Å²	155	76.9 Å²	76.9	72%	0.718	43%	0.426	S	S	*	.	H	α-helix	trans	-69.6	-23.9	178	-78	-61.4	0	0	0	113.4	N286 H287	N286-H290 WeakPolarHBondContact O-CB 3.38Å; N286-H290 PolarHBondContact O-CD2 3.25Å; N286-H290 PolarHBondContact O-N 3.14Å; H287-H290 PolarHBondContact O-N 3.42Å
291	N	92.8	Very high	93.8	Very high	48 Å²	48	77.3 Å²	77.3	26%	0.257	43%	0.43	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95	7.5	-179	-158	40.5	0	0	0	114.1	H287 L288 I289 D293 N294 D295	H287-N291 WeakPolarHBondContact O-CB 3.5Å; H287-N291 PolarHBondContact O-N 2.82Å; L288-N291 PolarHBondContact O-N 3.27Å; I289-N291 VanDerWaalsContact C-N 3.27Å; I289-N291 PolarHBondContact O-N 2.99Å; N291-D293 VanDerWaalsContact C-N 3.25Å; N291-D293 PolarHBondContact O-N 3.14Å; N291-N294 PolarHBondContact O-N 2.68Å; N291-N294 VanDerWaalsContact O-N 3.15Å; N291-N294 WeakPolarHBondContact OD1-CB 3.28Å; N291-N294 PolarHBondContact OD1-ND2 2.7Å; N291-N294 VanDerWaalsContact OD1-ND2 3.13Å; N291-D295 PolarHBondContact O-N 3.21Å
292	V	92	Very high	93.7	Very high	52 Å²	52	79.6 Å²	79.6	32%	0.315	44%	0.44	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56	-38.3	-177	170.4	0	0	0	0	112.8	L288 I289 P296 L299	L288-V292 WeakPolarHBondContact O-CG2 3.17Å; L288-V292 PolarHBondContact O-N 3.26Å; I289-V292 WeakPolarHBondContact O-CG2 3.39Å; I289-V292 PolarHBondContact O-N 3.37Å; V292-P296 WeakPolarHBondContact O-CA 3.3Å; V292-P296 WeakPolarHBondContact O-CB 3.27Å; V292-P296 VanDerWaalsContact O-CD 3.29Å; V292-P296 WeakPolarHBondContact O-CD 3.5Å; V292-L299 HydrophobicContact CG2-CD2 3.48Å; V292-L299 VanDerWaalsContact CG2-CD2 3.48Å
293	D	91.2	Very high	93.7	Very high	153 Å²	153	82.3 Å²	82.3	82%	0.818	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.8	-30.7	-177.6	-64.1	-36.3	0	0	0	112.8	N291	N291-D293 VanDerWaalsContact C-N 3.25Å; N291-D293 PolarHBondContact O-N 3.14Å
294	N	92.5	Very high	93.5	Very high	134 Å²	134	85.6 Å²	85.6	72%	0.717	45%	0.448	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.3	-35.3	-177	-57.8	-48	0	0	0	112.6	N291	N291-N294 PolarHBondContact O-N 2.68Å; N291-N294 VanDerWaalsContact O-N 3.15Å; N291-N294 WeakPolarHBondContact OD1-CB 3.28Å; N291-N294 PolarHBondContact OD1-ND2 2.7Å; N291-N294 VanDerWaalsContact OD1-ND2 3.13Å
295	D	92.8	Very high	93.3	Very high	59 Å²	59	86 Å²	86	32%	0.316	46%	0.458	S	S	.	.			trans	-146	75.6	-178.6	-176.8	15.8	0	0	0	111.5	N291 A297 S298	N291-D295 PolarHBondContact O-N 3.21Å; D295-A297 PolarHBondContact O-N 3.06Å; D295-A297 PolarHBondContact OD1-N 2.95Å; D295-S298 PolarHBondContact O-N 3.3Å; D295-S298 PolarHBondContact OD1-N 3.48Å; D295-S298 WeakPolarHBondContact OD2-CB 3.3Å; D295-S298 PolarHBondContact OD2-OG 2.83Å
296	P	91.2	Very high	93.3	Very high	73 Å²	73	86.4 Å²	86.4	47%	0.474	46%	0.46	S	S	.	.	H	α-helix	trans	-66.2	-22.6	178	25.6	-32.9	0	0	0	112.5	V292 L299 V300	V292-P296 WeakPolarHBondContact O-CA 3.3Å; V292-P296 WeakPolarHBondContact O-CB 3.27Å; V292-P296 VanDerWaalsContact O-CD 3.29Å; V292-P296 WeakPolarHBondContact O-CD 3.5Å; P296-L299 PolarHBondContact O-N 3.48Å; P296-V300 WeakPolarHBondContact O-CG2 3.42Å; P296-V300 PolarHBondContact O-N 3.14Å
297	A	92.9	Very high	93.2	Very high	63 Å²	63	87 Å²	87	52%	0.521	46%	0.459	S	S	.	.	H	α-helix	trans	-65.7	-40.3	-178.3	0	0	0	0	0	111.8	D295 L299 V300 Q301	D295-A297 PolarHBondContact O-N 3.06Å; D295-A297 PolarHBondContact OD1-N 2.95Å; A297-L299 PolarHBondContact O-N 3.44Å; A297-V300 PolarHBondContact O-N 3.19Å; A297-Q301 WeakPolarHBondContact O-CB 3.13Å; A297-Q301 PolarHBondContact O-N 3.36Å
298	S	93.1	Very high	93.1	Very high	34 Å²	34	82.9 Å²	82.9	24%	0.238	44%	0.441	C	S	.	.	H	α-helix	trans	-60.1	-43.3	175.8	-78.5	0	0	0	0	112.9	D295 L302	D295-S298 PolarHBondContact O-N 3.3Å; D295-S298 PolarHBondContact OD1-N 3.48Å; D295-S298 WeakPolarHBondContact OD2-CB 3.3Å; D295-S298 PolarHBondContact OD2-OG 2.83Å; S298-L302 WeakPolarHBondContact O-CB 3.47Å; S298-L302 WeakPolarHBondContact O-CG 2.81Å; S298-L302 PolarHBondContact O-N 3.33Å; S298-L302 VanDerWaalsContact O-N 3.08Å
299	L	93.6	Very high	93	Very high	48 Å²	48	85.3 Å²	85.3	25%	0.251	45%	0.449	S	S	.	.	H	α-helix	trans	-62.5	-48.6	176.4	176	63.8	0	0	0	110.6	L288 V292 P296 A297 Q301 L302 Y303	L288-L299 HydrophobicContact CB-CD1 4.07Å; V292-L299 HydrophobicContact CG2-CD2 3.48Å; V292-L299 VanDerWaalsContact CG2-CD2 3.48Å; P296-L299 PolarHBondContact O-N 3.48Å; A297-L299 PolarHBondContact O-N 3.44Å; L299-Q301 VanDerWaalsContact C-N 3.35Å; L299-Q301 PolarHBondContact O-N 3.48Å; L299-L302 PolarHBondContact O-N 3.32Å; L299-Y303 WeakPolarHBondContact O-CA 3.31Å; L299-Y303 VanDerWaalsContact O-CB 3.28Å; L299-Y303 WeakPolarHBondContact O-CB 3.06Å; L299-Y303 PolarHBondContact O-N 3.42Å
300	V	93.3	Very high	93	Very high	116 Å²	116	83.8 Å²	83.8	70%	0.703	44%	0.441	S	S	*	.	H	α-helix	trans	-62.6	-41.3	-178.8	174.7	0	0	0	0	111.5	P296 A297	P296-V300 WeakPolarHBondContact O-CG2 3.42Å; P296-V300 PolarHBondContact O-N 3.14Å; A297-V300 PolarHBondContact O-N 3.19Å
301	Q	93.3	Very high	93	Very high	156 Å²	156	79.8 Å²	79.8	73%	0.729	43%	0.425	S	S	*	.	H	α-helix	trans	-65.5	-40.9	179.2	-175.3	-178.6	14	0	0	112.4	A297 L299	A297-Q301 WeakPolarHBondContact O-CB 3.13Å; A297-Q301 PolarHBondContact O-N 3.36Å; L299-Q301 VanDerWaalsContact C-N 3.35Å; L299-Q301 PolarHBondContact O-N 3.48Å
302	L	94.9	Very high	92.9	Very high	56 Å²	56	77.6 Å²	77.6	29%	0.293	41%	0.413	S	S	.	.	H	α-helix	trans	-94.5	-11.3	-172.7	-62.8	176.4	0	0	0	113.9	F284 L288 S298 L299 E304 T305 V306	F284-L302 HydrophobicContact CE1-CD1 4.46Å; F284-L302 HydrophobicContact CZ-CD1 4.08Å; L288-L302 HydrophobicContact CD1-CB 4.33Å; L288-L302 HydrophobicContact CD1-CD1 4.37Å; L288-L302 HydrophobicContact CD2-CD1 4.28Å; S298-L302 WeakPolarHBondContact O-CB 3.47Å; S298-L302 WeakPolarHBondContact O-CG 2.81Å; S298-L302 PolarHBondContact O-N 3.33Å; S298-L302 VanDerWaalsContact O-N 3.08Å; L299-L302 PolarHBondContact O-N 3.32Å; L302-E304 PolarHBondContact O-N 3.32Å; L302-T305 PolarHBondContact O-N 2.9Å; L302-V306 HydrophobicContact CB-CG2 4.25Å; L302-V306 WeakPolarHBondContact O-CG2 3.28Å; L302-V306 PolarHBondContact O-N 3.4Å
303	Y	94.3	Very high	92.9	Very high	112 Å²	112	75.3 Å²	75.3	44%	0.439	40%	0.399	S	S	.	.	H	α-helix	trans	-47.4	-53.4	-173	174.4	-101.7	0	0	0	113.4	L299 T305 V306 K307	L299-Y303 WeakPolarHBondContact O-CA 3.31Å; L299-Y303 VanDerWaalsContact O-CB 3.28Å; L299-Y303 WeakPolarHBondContact O-CB 3.06Å; L299-Y303 PolarHBondContact O-N 3.42Å; Y303-T305 VanDerWaalsContact C-N 3.29Å; Y303-T305 PolarHBondContact O-N 3.3Å; Y303-V306 PolarHBondContact O-N 3.08Å; Y303-K307 HydrophobicContact CE1-CD 4.06Å; Y303-K307 VanDerWaalsContact O-CB 3.22Å; Y303-K307 WeakPolarHBondContact O-CB 3.48Å; Y303-K307 PolarHBondContact O-N 3.35Å
304	E	92.7	Very high	92.9	Very high	129 Å²	129	73 Å²	73	60%	0.603	38%	0.383	S	S	*	.	H	α-helix	trans	-63.9	-34	-177.8	-67.5	-60	150.5	0	0	112.7	L302 L308	L302-E304 PolarHBondContact O-N 3.32Å; E304-L308 VanDerWaalsContact O-CB 3.23Å; E304-L308 WeakPolarHBondContact O-CB 3.34Å; E304-L308 PolarHBondContact O-N 3.01Å; E304-L308 VanDerWaalsContact O-N 3.08Å
305	T	92.6	Very high	92.7	Very high	94 Å²	94	67.3 Å²	67.3	58%	0.577	35%	0.354	S	S	*	.	H	α-helix	trans	-74.2	-43	179.2	-58.5	0	0	0	0	111	L302 Y303 R309	L302-T305 PolarHBondContact O-N 2.9Å; Y303-T305 VanDerWaalsContact C-N 3.29Å; Y303-T305 PolarHBondContact O-N 3.3Å; T305-R309 WeakPolarHBondContact O-CB 3.31Å; T305-R309 PolarHBondContact O-N 2.86Å; T305-R309 VanDerWaalsContact O-N 3.09Å
306	V	94.5	Very high	92.5	Very high	23 Å²	23	64.5 Å²	64.5	14%	0.139	34%	0.339	C	S	.	.	H	α-helix	trans	-65.3	-48	177.2	173.1	0	0	0	0	110.2	F284 S285 L288 L302 Y303 L308 R309 L310	F284-V306 HydrophobicContact CD1-CG2 4.07Å; F284-V306 HydrophobicContact CE1-CG2 3.72Å; S285-V306 VanDerWaalsContact OG-CG1 3.22Å; S285-V306 WeakPolarHBondContact OG-CG1 3.47Å; L288-V306 HydrophobicContact CD1-CG2 3.83Å; L302-V306 HydrophobicContact CB-CG2 4.25Å; L302-V306 WeakPolarHBondContact O-CG2 3.28Å; L302-V306 PolarHBondContact O-N 3.4Å; Y303-V306 PolarHBondContact O-N 3.08Å; V306-L308 PolarHBondContact O-N 3.24Å; V306-R309 WeakPolarHBondContact O-CB 3.46Å; V306-R309 PolarHBondContact O-N 3.43Å; V306-R309 VanDerWaalsContact O-N 3.11Å; V306-L310 HydrophobicContact CG1-CD1 4.05Å; V306-L310 HydrophobicContact CG1-CG 4.36Å; V306-L310 WeakPolarHBondContact O-CG 3.43Å; V306-L310 PolarHBondContact O-N 3.31Å
307	K	94	Very high	92.4	Very high	90 Å²	90	62 Å²	62	39%	0.391	32%	0.323	S	S	.	.	H	α-helix	trans	-57.3	-52.2	177.8	-177.8	168.9	-179.3	175.3	0	111.8	Y303 R309 L310 D311	Y303-K307 HydrophobicContact CE1-CD 4.06Å; Y303-K307 VanDerWaalsContact O-CB 3.22Å; Y303-K307 WeakPolarHBondContact O-CB 3.48Å; Y303-K307 PolarHBondContact O-N 3.35Å; K307-R309 PolarHBondContact O-N 2.86Å; K307-L310 PolarHBondContact O-N 3.31Å; K307-L310 VanDerWaalsContact O-N 3.1Å; K307-D311 VanDerWaalsContact O-CG 3.28Å; K307-D311 PolarHBondContact O-N 3.11Å
308	L	91.3	Very high	92.2	Very high	30 Å²	30	63.6 Å²	63.6	16%	0.157	32%	0.32	C	S	.	.	H	α-helix	trans	-57.7	-34.7	177.2	-176.6	67.5	0	0	0	112.4	E304 V306 L312 K334 L335	E304-L308 VanDerWaalsContact O-CB 3.23Å; E304-L308 WeakPolarHBondContact O-CB 3.34Å; E304-L308 PolarHBondContact O-N 3.01Å; E304-L308 VanDerWaalsContact O-N 3.08Å; V306-L308 PolarHBondContact O-N 3.24Å; L308-L312 WeakPolarHBondContact O-CB 3.22Å; L308-L312 PolarHBondContact O-N 3.3Å; L308-K334 HydrophobicContact CD1-CD 4.41Å; L308-K334 HydrophobicContact CD2-CD 4.15Å; L308-L335 HydrophobicContact CD1-CD1 4.02Å
309	R	93	Very high	91.7	Very high	65 Å²	65	62 Å²	62	25%	0.245	31%	0.309	C	S	.	.	H	α-helix	trans	-72.1	-41.1	177.4	-178.7	54.2	165.4	168.8	-3.5	112.4	Q277 T305 V306 K307 L312 L313	Q277-R309 VanDerWaalsContact CD-NH2 3.32Å; T305-R309 WeakPolarHBondContact O-CB 3.31Å; T305-R309 PolarHBondContact O-N 2.86Å; T305-R309 VanDerWaalsContact O-N 3.09Å; V306-R309 WeakPolarHBondContact O-CB 3.46Å; V306-R309 PolarHBondContact O-N 3.43Å; V306-R309 VanDerWaalsContact O-N 3.11Å; K307-R309 PolarHBondContact O-N 2.86Å; R309-L312 PolarHBondContact O-N 3.38Å; R309-L313 HydrophobicContact CG-CD1 4.26Å; R309-L313 WeakPolarHBondContact O-CG 3.28Å; R309-L313 PolarHBondContact O-N 3.27Å
310	L	94.5	Very high	91.4	Very high	70 Å²	70	60.1 Å²	60.1	37%	0.366	30%	0.299	S	S	.	.	H	α-helix	trans	-63.1	-46.6	175.1	-67.3	174.9	0	0	0	110.6	A281 V306 K307 L312 L313 Q314	A281-L310 HydrophobicContact CB-CD2 4.12Å; V306-L310 HydrophobicContact CG1-CD1 4.05Å; V306-L310 HydrophobicContact CG1-CG 4.36Å; V306-L310 WeakPolarHBondContact O-CG 3.43Å; V306-L310 PolarHBondContact O-N 3.31Å; K307-L310 PolarHBondContact O-N 3.31Å; K307-L310 VanDerWaalsContact O-N 3.1Å; L310-L312 VanDerWaalsContact C-N 3.32Å; L310-L312 PolarHBondContact O-N 2.82Å; L310-L313 PolarHBondContact O-N 3.38Å; L310-Q314 WeakPolarHBondContact O-CB 3.42Å; L310-Q314 PolarHBondContact O-N 3.48Å
311	D	91.8	Very high	91.1	Very high	71 Å²	71	60.2 Å²	60.2	38%	0.38	30%	0.295	S	S	.	.	H	α-helix	trans	-59.7	-42	177.2	-64.4	-21.3	0	0	0	111.3	K307 Q314 V315 L335	K307-D311 VanDerWaalsContact O-CG 3.28Å; K307-D311 PolarHBondContact O-N 3.11Å; D311-Q314 PolarHBondContact O-N 2.88Å; D311-V315 WeakPolarHBondContact O-CG2 3.33Å; D311-V315 PolarHBondContact O-N 3.08Å; D311-L335 HydrophobicContact CB-CD2 4.28Å
312	L	90.3	Very high	90.5	Very high	1 Å²	1	55.9 Å²	55.9	1%	0.005	28%	0.282	C	S	.	.	H	α-helix	trans	-61.1	-47.3	175.5	176.5	63.4	0	0	0	112.6	L308 R309 L310 Q314 L316 L335 R338 I339	L308-L312 WeakPolarHBondContact O-CB 3.22Å; L308-L312 PolarHBondContact O-N 3.3Å; R309-L312 PolarHBondContact O-N 3.38Å; L310-L312 VanDerWaalsContact C-N 3.32Å; L310-L312 PolarHBondContact O-N 2.82Å; L312-Q314 VanDerWaalsContact C-N 3.32Å; L312-L316 HydrophobicContact CD1-CD1 3.99Å; L312-L316 HydrophobicContact CD1-CG 4.29Å; L312-L316 HydrophobicContact CG-CD1 4.04Å; L312-L316 WeakPolarHBondContact O-CB 3.29Å; L312-L316 VanDerWaalsContact O-CG 3.28Å; L312-L316 WeakPolarHBondContact O-CG 3.36Å; L312-L316 PolarHBondContact O-N 2.85Å; L312-L316 VanDerWaalsContact O-N 3.07Å; L312-L335 HydrophobicContact CB-CD1 3.67Å; L312-L335 HydrophobicContact CD1-CD1 3.94Å; L312-L335 HydrophobicContact CG-CD1 4.38Å; L312-R338 HydrophobicContact CD1-CB 4.35Å; L312-R338 HydrophobicContact CD2-CB 4.26Å; L312-I339 HydrophobicContact CD1-CD1 4.48Å; L312-I339 HydrophobicContact CD1-CG1 3.48Å; L312-I339 VanDerWaalsContact CD1-CG1 3.48Å
313	L	92.7	Very high	89.5	Confident	5 Å²	5	54.8 Å²	54.8	3%	0.026	28%	0.276	C	S	.	.	H	α-helix	trans	-67.8	-36.1	-179.5	-69.2	171	0	0	0	111.5	L274 Q277 I278 A281 R309 L310 S317 L344	L274-L313 HydrophobicContact CD1-CD2 3.73Å; Q277-L313 HydrophobicContact CB-CD2 4.05Å; I278-L313 HydrophobicContact CG1-CB 4.09Å; I278-L313 HydrophobicContact CG1-CD1 4.4Å; I278-L313 HydrophobicContact CG1-CD2 4.49Å; A281-L313 HydrophobicContact CB-CD1 3.56Å; R309-L313 HydrophobicContact CG-CD1 4.26Å; R309-L313 WeakPolarHBondContact O-CG 3.28Å; R309-L313 PolarHBondContact O-N 3.27Å; L310-L313 PolarHBondContact O-N 3.38Å; L313-S317 WeakPolarHBondContact O-CB 3.4Å; L313-S317 PolarHBondContact O-N 3.13Å; L313-S317 PolarHBondContact O-OG 3.3Å; L313-L344 HydrophobicContact CD2-CD1 4.06Å
314	Q	91.1	Very high	88.4	Confident	103 Å²	103	51.1 Å²	51.1	48%	0.481	27%	0.267	S	S	.	.	H	α-helix	trans	-60.7	-53	174.9	-175.9	62.6	30.6	0	0	110.8	L310 D311 L312 L316 S317 E318	L310-Q314 WeakPolarHBondContact O-CB 3.42Å; L310-Q314 PolarHBondContact O-N 3.48Å; D311-Q314 PolarHBondContact O-N 2.88Å; L312-Q314 VanDerWaalsContact C-N 3.32Å; Q314-L316 PolarHBondContact O-N 3Å; Q314-S317 PolarHBondContact O-N 3.4Å; Q314-S317 VanDerWaalsContact O-N 3.14Å; Q314-S317 PolarHBondContact O-OG 3.04Å; Q314-E318 PolarHBondContact NE2-OE1 3.48Å; Q314-E318 WeakPolarHBondContact O-CG 3.27Å; Q314-E318 PolarHBondContact O-N 3.18Å
315	V	88.3	Confident	87.1	Confident	16 Å²	16	48.7 Å²	48.7	10%	0.097	26%	0.262	C	S	.	.	H	α-helix	trans	-60.5	-43.8	179.6	172.2	0	0	0	0	111.8	D311 S317 E318 Q319 L331 L335 I339	D311-V315 WeakPolarHBondContact O-CG2 3.33Å; D311-V315 PolarHBondContact O-N 3.08Å; V315-S317 VanDerWaalsContact C-N 3.3Å; V315-S317 PolarHBondContact O-N 2.76Å; V315-E318 PolarHBondContact O-N 3.17Å; V315-Q319 WeakPolarHBondContact O-CB 3.29Å; V315-Q319 PolarHBondContact O-N 2.97Å; V315-L331 HydrophobicContact CG1-CD2 3.92Å; V315-L331 HydrophobicContact CG2-CD1 3.87Å; V315-L331 HydrophobicContact CG2-CD2 4.18Å; V315-L335 HydrophobicContact CG2-CD2 4.15Å; V315-I339 HydrophobicContact CG1-CD1 3.86Å
316	L	88.7	Confident	85.6	Confident	0 Å²	0	48.2 Å²	48.2	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-62.7	-38	177.3	-72.3	170.7	0	0	0	112.2	L274 L312 Q314 Q319 I320 I339 L344 W345	L274-L316 HydrophobicContact CD1-CB 4.24Å; L274-L316 HydrophobicContact CD2-CB 4.49Å; L312-L316 HydrophobicContact CD1-CD1 3.99Å; L312-L316 HydrophobicContact CD1-CG 4.29Å; L312-L316 HydrophobicContact CG-CD1 4.04Å; L312-L316 WeakPolarHBondContact O-CB 3.29Å; L312-L316 VanDerWaalsContact O-CG 3.28Å; L312-L316 WeakPolarHBondContact O-CG 3.36Å; L312-L316 PolarHBondContact O-N 2.85Å; L312-L316 VanDerWaalsContact O-N 3.07Å; Q314-L316 PolarHBondContact O-N 3Å; L316-Q319 PolarHBondContact O-N 2.92Å; L316-I320 WeakPolarHBondContact O-CG1 3.49Å; L316-I320 PolarHBondContact O-N 3.29Å; L316-I320 VanDerWaalsContact O-N 3.1Å; L316-I339 HydrophobicContact CD2-CG1 4.4Å; L316-I339 HydrophobicContact CD2-CG2 4.21Å; L316-L344 HydrophobicContact CD1-CB 3.9Å; L316-L344 HydrophobicContact CD1-CD1 3.87Å; L316-W345 HydrophobicContact CD2-CB 4.04Å
317	S	89.7	Confident	84	Confident	21 Å²	21	49 Å²	49	15%	0.147	27%	0.272	C	S	.	.	H	α-helix	trans	-66.3	-43.2	176.1	75	0	0	0	0	112	L313 Q314 V315 Q319 I320 L321	L313-S317 WeakPolarHBondContact O-CB 3.4Å; L313-S317 PolarHBondContact O-N 3.13Å; L313-S317 PolarHBondContact O-OG 3.3Å; Q314-S317 PolarHBondContact O-N 3.4Å; Q314-S317 VanDerWaalsContact O-N 3.14Å; Q314-S317 PolarHBondContact O-OG 3.04Å; V315-S317 VanDerWaalsContact C-N 3.3Å; V315-S317 PolarHBondContact O-N 2.76Å; S317-Q319 VanDerWaalsContact C-N 3.29Å; S317-Q319 PolarHBondContact O-N 2.94Å; S317-I320 PolarHBondContact O-N 2.93Å; S317-L321 WeakPolarHBondContact O-CB 3.37Å; S317-L321 WeakPolarHBondContact O-CG 3.43Å; S317-L321 PolarHBondContact O-N 2.92Å
318	E	88	Confident	82.5	Confident	96 Å²	96	46.5 Å²	46.5	45%	0.449	26%	0.262	S	S	.	.	H	α-helix	trans	-64	-36.2	175.9	-71.9	172.9	-174.6	0	0	111.4	Q314 V315 L321 S322	Q314-E318 PolarHBondContact NE2-OE1 3.48Å; Q314-E318 WeakPolarHBondContact O-CG 3.27Å; Q314-E318 PolarHBondContact O-N 3.18Å; V315-E318 PolarHBondContact O-N 3.17Å; E318-L321 PolarHBondContact O-N 3Å; E318-S322 WeakPolarHBondContact O-CB 3.22Å; E318-S322 PolarHBondContact O-N 3.03Å; E318-S322 PolarHBondContact O-OG 3.26Å
319	Q	83.8	Confident	81.5	Confident	0 Å²	0	51.4 Å²	51.4	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-66.9	-44.8	177.8	-164.1	179.2	-8.9	0	0	112.2	V315 L316 S317 S322 D323 S324 W345	V315-Q319 WeakPolarHBondContact O-CB 3.29Å; V315-Q319 PolarHBondContact O-N 2.97Å; L316-Q319 PolarHBondContact O-N 2.92Å; S317-Q319 VanDerWaalsContact C-N 3.29Å; S317-Q319 PolarHBondContact O-N 2.94Å; Q319-S322 PolarHBondContact O-OG 3.19Å; Q319-D323 PolarHBondContact O-N 3.36Å; Q319-S324 WeakPolarHBondContact CG-O 3.35Å; Q319-W345 HydrophobicContact CB-CE3 4.49Å; Q319-W345 HydrophobicContact CB-CZ3 4.08Å; Q319-W345 HydrophobicContact CG-CE3 4.09Å; Q319-W345 HydrophobicContact CG-CH2 3.63Å; Q319-W345 HydrophobicContact CG-CZ2 4.19Å; Q319-W345 HydrophobicContact CG-CZ3 3.56Å
320	I	86.4	Confident	80.5	Confident	9 Å²	9	54.1 Å²	54.1	5%	0.046	32%	0.317	C	S	.	.	H	α-helix	trans	-65.5	-40.1	175.8	-66.6	177.7	0	0	0	111.1	L270 I271 L274 L316 S317 W345 V349 W352	L270-I320 HydrophobicContact CD2-CD1 3.8Å; L270-I320 HydrophobicContact CD2-CG1 4.48Å; L270-I320 HydrophobicContact CG-CD1 4.14Å; I271-I320 HydrophobicContact CD1-CG2 4.32Å; I271-I320 HydrophobicContact CG1-CG2 3.98Å; L274-I320 HydrophobicContact CD2-CD1 3.66Å; L316-I320 WeakPolarHBondContact O-CG1 3.49Å; L316-I320 PolarHBondContact O-N 3.29Å; L316-I320 VanDerWaalsContact O-N 3.1Å; S317-I320 PolarHBondContact O-N 2.93Å; I320-W345 HydrophobicContact CG1-CE3 4.14Å; I320-W345 HydrophobicContact CG1-CZ3 3.82Å; I320-V349 HydrophobicContact CG2-CG1 4.49Å; I320-W352 PolarHBondContact O-NE1 3.32Å
321	L	86.8	Confident	79.6	Confident	118 Å²	118	52.6 Å²	52.6	62%	0.618	31%	0.31	S	S	*	.	H	α-helix	trans	-72.7	-35.3	-179.7	-71	172	0	0	0	113.4	S317 E318 D323	S317-L321 WeakPolarHBondContact O-CB 3.37Å; S317-L321 WeakPolarHBondContact O-CG 3.43Å; S317-L321 PolarHBondContact O-N 2.92Å; E318-L321 PolarHBondContact O-N 3Å; L321-D323 VanDerWaalsContact C-N 3.28Å
322	S	81.7	Confident	79.1	Confident	65 Å²	65	54.3 Å²	54.3	46%	0.455	32%	0.319	S	S	.	.	H	α-helix	trans	-79.5	-12.2	178.7	59.5	0	0	0	0	113.4	E318 Q319 S324	E318-S322 WeakPolarHBondContact O-CB 3.22Å; E318-S322 PolarHBondContact O-N 3.03Å; E318-S322 PolarHBondContact O-OG 3.26Å; Q319-S322 PolarHBondContact O-OG 3.19Å; S322-S324 PolarHBondContact O-N 3.4Å; S322-S324 VanDerWaalsContact O-N 3.09Å
323	D	73.7	Confident	78.6	Confident	32 Å²	32	59.3 Å²	59.3	17%	0.171	34%	0.342	C	S	.	.	T	Hydrogen-bonded Turn	trans	53.3	27.3	-177.1	-150	19.1	0	0	0	113.2	Q319 L321 V350 G351 W352	Q319-D323 PolarHBondContact O-N 3.36Å; L321-D323 VanDerWaalsContact C-N 3.28Å; D323-V350 WeakPolarHBondContact OD1-CA 3.27Å; D323-G351 VanDerWaalsContact CG-N 3.26Å; D323-G351 PolarHBondContact OD1-N 3.4Å; D323-G351 WeakPolarHBondContact OD2-CA 3.4Å; D323-G351 PolarHBondContact OD2-N 3.37Å; D323-W352 PolarHBondContact OD2-N 2.89Å
324	S	70.8	Confident	78.1	Confident	36 Å²	36	64.9 Å²	64.9	25%	0.252	37%	0.366	S	S	.	.			trans	-130.1	129.2	-175.7	-178.3	0	0	0	0	111.7	Q319 S322 S326	Q319-S324 WeakPolarHBondContact CG-O 3.35Å; S322-S324 PolarHBondContact O-N 3.4Å; S322-S324 VanDerWaalsContact O-N 3.09Å; S324-S326 PolarHBondContact O-N 2.97Å; S324-S326 WeakPolarHBondContact OG-CB 3.05Å; S324-S326 PolarHBondContact OG-N 3.44Å; S324-S326 PolarHBondContact OG-OG 2.88Å
325	P	66	Low	77.7	Confident	78 Å²	78	60.6 Å²	60.6	51%	0.506	35%	0.346	S	S	.	.	G	3₁₀ helix	trans	-70.9	-11.9	172.2	23.5	-25.2	0	0	0	113.5	A327	P325-A327 PolarHBondContact O-N 3.27Å; P325-A327 VanDerWaalsContact O-N 3.14Å
326	S	61.4	Low	77.3	Confident	84 Å²	84	61.9 Å²	61.9	59%	0.587	35%	0.351	S	S	*	.	G	3₁₀ helix	trans	-73.4	-4	-169.6	70.2	0	0	0	0	115.6	S324 I328	S324-S326 PolarHBondContact O-N 2.97Å; S324-S326 WeakPolarHBondContact OG-CB 3.05Å; S324-S326 PolarHBondContact OG-N 3.44Å; S324-S326 PolarHBondContact OG-OG 2.88Å; S326-I328 VanDerWaalsContact C-N 3.25Å; S326-I328 PolarHBondContact O-N 2.89Å
327	A	59.5	Low	77.1	Confident	40 Å²	40	65.2 Å²	65.2	33%	0.331	37%	0.368	S	S	.	.	G	3₁₀ helix	trans	-72.4	-16.6	-179.3	0	0	0	0	0	113.6	P325	P325-A327 PolarHBondContact O-N 3.27Å; P325-A327 VanDerWaalsContact O-N 3.14Å
328	I	63.4	Low	76.7	Confident	36 Å²	36	68.5 Å²	68.5	19%	0.185	38%	0.378	C	S	.	.	G	3₁₀ helix	trans	-76.5	-28.3	-172.4	-61.4	177.4	0	0	0	112.3	S326 S330 L331 K336 I339	S326-I328 VanDerWaalsContact C-N 3.25Å; S326-I328 PolarHBondContact O-N 2.89Å; I328-S330 VanDerWaalsContact C-N 3.32Å; I328-S330 PolarHBondContact O-N 3.42Å; I328-L331 VanDerWaalsContact O-CB 3.26Å; I328-L331 WeakPolarHBondContact O-CB 3.11Å; I328-L331 PolarHBondContact O-N 3.28Å; I328-L331 VanDerWaalsContact O-N 3.15Å; I328-K336 HydrophobicContact CG2-CG 3.92Å; I328-K336 WeakPolarHBondContact O-CE 3.47Å; I328-I339 HydrophobicContact CD1-CG2 3.96Å; I328-I339 HydrophobicContact CG1-CD1 4.45Å
329	D	69.6	Low	76.3	Confident	133 Å²	133	64.2 Å²	64.2	71%	0.711	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.2	-30.6	-168.6	-74.6	-25.1	0	0	0	114.2	L331 K336	D329-L331 VanDerWaalsContact C-N 3.26Å; D329-L331 PolarHBondContact O-N 2.84Å; D329-K336 PolarHBondContact O-NZ 3.46Å
330	S	72.5	Confident	76	Confident	122 Å²	122	72.3 Å²	72.3	85%	0.853	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.8	-0.2	179.8	-172.1	0	0	0	0	114.2	I328	I328-S330 VanDerWaalsContact C-N 3.32Å; I328-S330 PolarHBondContact O-N 3.42Å
331	L	75.6	Confident	75.7	Confident	39 Å²	39	79.4 Å²	79.4	20%	0.204	43%	0.426	C	S	.	.	S	Bend	trans	-92.9	154.1	-166.5	-149.8	66.5	0	0	0	113.7	V315 I328 D329 L335 K336 I339	V315-L331 HydrophobicContact CG1-CD2 3.92Å; V315-L331 HydrophobicContact CG2-CD1 3.87Å; V315-L331 HydrophobicContact CG2-CD2 4.18Å; I328-L331 VanDerWaalsContact O-CB 3.26Å; I328-L331 WeakPolarHBondContact O-CB 3.11Å; I328-L331 PolarHBondContact O-N 3.28Å; I328-L331 VanDerWaalsContact O-N 3.15Å; D329-L331 VanDerWaalsContact C-N 3.26Å; D329-L331 PolarHBondContact O-N 2.84Å; L331-L335 HydrophobicContact CD1-CD2 3.73Å; L331-L335 HydrophobicContact CD2-CB 3.73Å; L331-L335 HydrophobicContact CD2-CD2 3.43Å; L331-L335 VanDerWaalsContact CD2-CD2 3.43Å; L331-L335 HydrophobicContact CD2-CG 3.41Å; L331-L335 VanDerWaalsContact CD2-CG 3.41Å; L331-L335 HydrophobicContact CG-CB 3.92Å; L331-L335 HydrophobicContact CG-CD2 3.6Å; L331-L335 HydrophobicContact CG-CG 3.95Å; L331-K336 HydrophobicContact CB-CG 4.12Å; L331-K336 WeakPolarHBondContact O-CE 3.25Å; L331-K336 PolarHBondContact O-NZ 3.38Å; L331-I339 HydrophobicContact CD2-CD1 3.54Å
332	D	80.4	Confident	75.3	Confident	106 Å²	106	74.8 Å²	74.8	57%	0.567	40%	0.403	S	S	*	.			trans	-57.6	142	173.3	-179.9	54.3	0	0	0	111.6	K334 L335 K336	D332-K334 VanDerWaalsContact C-N 3.25Å; D332-K334 PolarHBondContact O-N 3.11Å; D332-K334 WeakPolarHBondContact OD2-CB 2.97Å; D332-K334 PolarHBondContact OD2-N 3.26Å; D332-L335 PolarHBondContact O-N 2.72Å; D332-K336 PolarHBondContact O-N 3.48Å
333	Q	80.9	Confident	75.2	Confident	107 Å²	107	76.4 Å²	76.4	50%	0.5	42%	0.415	S	S	.	.	H	α-helix	trans	-59.6	-37.6	-173.6	-172.8	60.9	41.9	0	0	111.9	L335 K336 D337	Q333-L335 VanDerWaalsContact C-N 3.25Å; Q333-L335 PolarHBondContact O-N 2.9Å; Q333-K336 WeakPolarHBondContact O-CB 3.45Å; Q333-K336 PolarHBondContact O-N 3.43Å; Q333-D337 PolarHBondContact NE2-OD1 3.24Å; Q333-D337 VanDerWaalsContact O-CG 3.24Å; Q333-D337 PolarHBondContact O-N 3.25Å
334	K	82	Confident	75.4	Confident	122 Å²	122	75 Å²	75	53%	0.53	41%	0.408	S	S	.	.	H	α-helix	trans	-61.6	-37.1	177.8	-168.1	-178	-177.4	-176.5	0	111.5	L308 D332 R338	L308-K334 HydrophobicContact CD1-CD 4.41Å; L308-K334 HydrophobicContact CD2-CD 4.15Å; D332-K334 VanDerWaalsContact C-N 3.25Å; D332-K334 PolarHBondContact O-N 3.11Å; D332-K334 WeakPolarHBondContact OD2-CB 2.97Å; D332-K334 PolarHBondContact OD2-N 3.26Å; K334-R338 WeakPolarHBondContact O-CG 3.45Å; K334-R338 PolarHBondContact O-N 2.82Å
335	L	82.5	Confident	75.8	Confident	12 Å²	12	75.5 Å²	75.5	6%	0.063	40%	0.404	C	S	.	.	H	α-helix	trans	-76.5	-38.2	179.6	-163	56.3	0	0	0	111.3	L308 D311 L312 V315 L331 D332 Q333 D337 R338 I339	L308-L335 HydrophobicContact CD1-CD1 4.02Å; D311-L335 HydrophobicContact CB-CD2 4.28Å; L312-L335 HydrophobicContact CB-CD1 3.67Å; L312-L335 HydrophobicContact CD1-CD1 3.94Å; L312-L335 HydrophobicContact CG-CD1 4.38Å; V315-L335 HydrophobicContact CG2-CD2 4.15Å; L331-L335 HydrophobicContact CD1-CD2 3.73Å; L331-L335 HydrophobicContact CD2-CB 3.73Å; L331-L335 HydrophobicContact CD2-CD2 3.43Å; L331-L335 VanDerWaalsContact CD2-CD2 3.43Å; L331-L335 HydrophobicContact CD2-CG 3.41Å; L331-L335 VanDerWaalsContact CD2-CG 3.41Å; L331-L335 HydrophobicContact CG-CB 3.92Å; L331-L335 HydrophobicContact CG-CD2 3.6Å; L331-L335 HydrophobicContact CG-CG 3.95Å; D332-L335 PolarHBondContact O-N 2.72Å; Q333-L335 VanDerWaalsContact C-N 3.25Å; Q333-L335 PolarHBondContact O-N 2.9Å; L335-D337 VanDerWaalsContact C-N 3.35Å; L335-D337 PolarHBondContact O-N 3.46Å; L335-R338 PolarHBondContact O-N 3.24Å; L335-I339 WeakPolarHBondContact O-CG1 3.43Å; L335-I339 PolarHBondContact O-N 3.44Å
336	K	80.8	Confident	76.5	Confident	43 Å²	43	73.9 Å²	73.9	19%	0.187	40%	0.395	C	S	.	.	H	α-helix	trans	-56.3	-46.6	171.7	-70.3	176.9	168.3	162.3	0	112.2	I328 D329 L331 D332 Q333 R338 I339 K340	I328-K336 HydrophobicContact CG2-CG 3.92Å; I328-K336 WeakPolarHBondContact O-CE 3.47Å; D329-K336 PolarHBondContact O-NZ 3.46Å; L331-K336 HydrophobicContact CB-CG 4.12Å; L331-K336 WeakPolarHBondContact O-CE 3.25Å; L331-K336 PolarHBondContact O-NZ 3.38Å; D332-K336 PolarHBondContact O-N 3.48Å; Q333-K336 WeakPolarHBondContact O-CB 3.45Å; Q333-K336 PolarHBondContact O-N 3.43Å; K336-R338 VanDerWaalsContact C-N 3.33Å; K336-R338 PolarHBondContact O-N 2.95Å; K336-I339 PolarHBondContact O-N 3.44Å; K336-K340 PolarHBondContact O-N 3.37Å; K336-K340 VanDerWaalsContact O-N 3.17Å
337	D	83.2	Confident	77.3	Confident	70 Å²	70	77.6 Å²	77.6	37%	0.374	40%	0.402	S	S	.	.	H	α-helix	trans	-62.9	-41.5	179.9	-64.5	-20.4	0	0	0	110.9	Q333 L335 I339 K340 E341	Q333-D337 PolarHBondContact NE2-OD1 3.24Å; Q333-D337 VanDerWaalsContact O-CG 3.24Å; Q333-D337 PolarHBondContact O-N 3.25Å; L335-D337 VanDerWaalsContact C-N 3.35Å; L335-D337 PolarHBondContact O-N 3.46Å; D337-I339 PolarHBondContact O-N 2.93Å; D337-K340 PolarHBondContact O-N 3.26Å; D337-E341 WeakPolarHBondContact O-CG 3.47Å; D337-E341 PolarHBondContact O-N 2.85Å; D337-E341 VanDerWaalsContact O-N 3.16Å
338	R	81.3	Confident	78.2	Confident	91 Å²	91	79.7 Å²	79.7	34%	0.343	41%	0.408	S	S	.	.	H	α-helix	trans	-68.3	-31.8	176.5	-68.7	-152.4	76.1	-161.3	3.7	114.5	L312 K334 L335 K336 E341 S342	L312-R338 HydrophobicContact CD1-CB 4.35Å; L312-R338 HydrophobicContact CD2-CB 4.26Å; K334-R338 WeakPolarHBondContact O-CG 3.45Å; K334-R338 PolarHBondContact O-N 2.82Å; L335-R338 PolarHBondContact O-N 3.24Å; K336-R338 VanDerWaalsContact C-N 3.33Å; K336-R338 PolarHBondContact O-N 2.95Å; R338-E341 PolarHBondContact O-N 3.47Å; R338-S342 WeakPolarHBondContact O-CB 3.28Å; R338-S342 PolarHBondContact O-N 3.43Å; R338-S342 VanDerWaalsContact O-N 3.16Å
339	I	79.6	Confident	78.9	Confident	6 Å²	6	78 Å²	78	3%	0.031	40%	0.4	C	S	.	.	H	α-helix	trans	-65.2	-44.3	174.1	-69.8	167.4	0	0	0	109.7	L312 V315 L316 I328 L331 L335 K336 D337 E341 S342	L312-I339 HydrophobicContact CD1-CD1 4.48Å; L312-I339 HydrophobicContact CD1-CG1 3.48Å; L312-I339 VanDerWaalsContact CD1-CG1 3.48Å; V315-I339 HydrophobicContact CG1-CD1 3.86Å; L316-I339 HydrophobicContact CD2-CG1 4.4Å; L316-I339 HydrophobicContact CD2-CG2 4.21Å; I328-I339 HydrophobicContact CD1-CG2 3.96Å; I328-I339 HydrophobicContact CG1-CD1 4.45Å; L331-I339 HydrophobicContact CD2-CD1 3.54Å; L335-I339 WeakPolarHBondContact O-CG1 3.43Å; L335-I339 PolarHBondContact O-N 3.44Å; K336-I339 PolarHBondContact O-N 3.44Å; D337-I339 PolarHBondContact O-N 2.93Å; I339-E341 VanDerWaalsContact C-N 3.27Å; I339-E341 PolarHBondContact O-N 2.81Å; I339-S342 WeakPolarHBondContact O-CB 3.42Å; I339-S342 PolarHBondContact O-N 3.5Å
340	K	78.1	Confident	79.4	Confident	170 Å²	170	73.9 Å²	73.9	74%	0.739	38%	0.379	S	S	*	.	H	α-helix	trans	-62.2	-33	177.7	-69.9	179.2	179.4	180	0	113.2	K336 D337 S342	K336-K340 PolarHBondContact O-N 3.37Å; K336-K340 VanDerWaalsContact O-N 3.17Å; D337-K340 PolarHBondContact O-N 3.26Å; K340-S342 VanDerWaalsContact C-N 3.33Å
341	E	78.9	Confident	79.8	Confident	157 Å²	157	69 Å²	69	73%	0.734	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.5	-10.7	175.8	-68.2	175.5	177.3	0	0	113.6	D337 R338 I339	D337-E341 WeakPolarHBondContact O-CG 3.47Å; D337-E341 PolarHBondContact O-N 2.85Å; D337-E341 VanDerWaalsContact O-N 3.16Å; R338-E341 PolarHBondContact O-N 3.47Å; I339-E341 VanDerWaalsContact C-N 3.27Å; I339-E341 PolarHBondContact O-N 2.81Å
342	S	79.2	Confident	80.1	Confident	21 Å²	21	69.1 Å²	69.1	15%	0.147	35%	0.346	C	S	.	.			trans	-84.2	127.3	-171.7	-174.4	0	0	0	0	112	R338 I339 K340 L344	R338-S342 WeakPolarHBondContact O-CB 3.28Å; R338-S342 PolarHBondContact O-N 3.43Å; R338-S342 VanDerWaalsContact O-N 3.16Å; I339-S342 WeakPolarHBondContact O-CB 3.42Å; I339-S342 PolarHBondContact O-N 3.5Å; K340-S342 VanDerWaalsContact C-N 3.33Å; S342-L344 PolarHBondContact O-N 2.63Å; S342-L344 VanDerWaalsContact O-N 3.11Å; S342-L344 VanDerWaalsContact OG-CB 3.32Å; S342-L344 WeakPolarHBondContact OG-CB 3.42Å; S342-L344 WeakPolarHBondContact OG-CG 3.32Å; S342-L344 PolarHBondContact OG-N 3.13Å
343	S	79.1	Confident	80.1	Confident	100 Å²	100	67.6 Å²	67.6	70%	0.699	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.8	6.5	169.6	70.8	0	0	0	0	114
344	L	79.6	Confident	80	Confident	3 Å²	3	67 Å²	67	2%	0.016	34%	0.339	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.4	4.4	-178	-57.5	165.9	0	0	0	112.7	L270 K273 L274 L313 L316 S342	L270-L344 VanDerWaalsContact CD1-C 3.5Å; L270-L344 WeakPolarHBondContact CD1-O 3.45Å; L270-L344 WeakPolarHBondContact CD2-O 3.08Å; K273-L344 HydrophobicContact CB-CD2 4.33Å; L274-L344 HydrophobicContact CD1-CD1 4.32Å; L313-L344 HydrophobicContact CD2-CD1 4.06Å; L316-L344 HydrophobicContact CD1-CB 3.9Å; L316-L344 HydrophobicContact CD1-CD1 3.87Å; S342-L344 PolarHBondContact O-N 2.63Å; S342-L344 VanDerWaalsContact O-N 3.11Å; S342-L344 VanDerWaalsContact OG-CB 3.32Å; S342-L344 WeakPolarHBondContact OG-CB 3.42Å; S342-L344 WeakPolarHBondContact OG-CG 3.32Å; S342-L344 PolarHBondContact OG-N 3.13Å
345	W	78.4	Confident	80	Confident	45 Å²	45	61.7 Å²	61.7	17%	0.17	32%	0.316	C	S	.	.			trans	-127.6	140.8	172.8	-178.9	-106.5	0	0	0	110.3	L316 Q319 I320 V350	L316-W345 HydrophobicContact CD2-CB 4.04Å; Q319-W345 HydrophobicContact CB-CE3 4.49Å; Q319-W345 HydrophobicContact CB-CZ3 4.08Å; Q319-W345 HydrophobicContact CG-CE3 4.09Å; Q319-W345 HydrophobicContact CG-CH2 3.63Å; Q319-W345 HydrophobicContact CG-CZ2 4.19Å; Q319-W345 HydrophobicContact CG-CZ3 3.56Å; I320-W345 HydrophobicContact CG1-CE3 4.14Å; I320-W345 HydrophobicContact CG1-CZ3 3.82Å; W345-V350 HydrophobicContact CH2-CG2 3.88Å; W345-V350 HydrophobicContact CZ2-CG2 3.74Å
346	S	79.8	Confident	79.9	Confident	45 Å²	45	64.4 Å²	64.4	32%	0.315	33%	0.333	S	S	.	.			trans	-145.6	135.6	170.5	176.4	0	0	0	0	108.6	N348 V349	S346-N348 PolarHBondContact O-N 2.8Å; S346-N348 PolarHBondContact OG-N 3.42Å; S346-V349 WeakPolarHBondContact O-CB 3.41Å; S346-V349 PolarHBondContact O-N 2.82Å
347	E	78.4	Confident	79.9	Confident	161 Å²	161	67.8 Å²	67.8	75%	0.752	35%	0.353	S	S	*	.	G	3₁₀ helix	trans	-62.8	-22.8	176.7	-67.7	-178.9	172.2	0	0	112.5	V349 V350	E347-V349 PolarHBondContact O-N 3.47Å; E347-V349 VanDerWaalsContact O-N 3.12Å; E347-V350 WeakPolarHBondContact O-CB 3.41Å; E347-V350 PolarHBondContact O-N 3.35Å; E347-V350 VanDerWaalsContact O-N 3.16Å
348	N	78.4	Confident	79.7	Confident	84 Å²	84	67.2 Å²	67.2	45%	0.449	35%	0.352	S	S	.	.	G	3₁₀ helix	trans	-62.7	-18.5	176.8	-68.7	-3.7	0	0	0	113.8	E266 S346	E266-N348 WeakPolarHBondContact OE2-CB 3.45Å; E266-N348 PolarHBondContact OE2-ND2 3.39Å; S346-N348 PolarHBondContact O-N 2.8Å; S346-N348 PolarHBondContact OG-N 3.42Å
349	V	79	Confident	79.6	Confident	2 Å²	2	71.6 Å²	71.6	1%	0.012	37%	0.369	C	S	.	.	G	3₁₀ helix	trans	-80.9	-19.3	-179.3	176	0	0	0	0	112.1	T267 L270 I320 S346 E347 G351 W352	T267-V349 HydrophobicContact CG2-CG1 3.68Å; L270-V349 HydrophobicContact CB-CG2 4.43Å; L270-V349 HydrophobicContact CD2-CB 4.3Å; L270-V349 HydrophobicContact CD2-CG1 4.39Å; L270-V349 HydrophobicContact CD2-CG2 3.59Å; I320-V349 HydrophobicContact CG2-CG1 4.49Å; S346-V349 WeakPolarHBondContact O-CB 3.41Å; S346-V349 PolarHBondContact O-N 2.82Å; E347-V349 PolarHBondContact O-N 3.47Å; E347-V349 VanDerWaalsContact O-N 3.12Å; V349-G351 PolarHBondContact O-N 3.26Å; V349-W352 WeakPolarHBondContact O-CB 3.38Å; V349-W352 VanDerWaalsContact O-CD1 3.27Å; V349-W352 PolarHBondContact O-N 3.03Å
350	V	80.6	Confident	79.5	Confident	45 Å²	45	75.1 Å²	75.1	27%	0.273	40%	0.399	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.5	134.5	178.7	-177.6	0	0	0	0	110.4	D323 W345 E347	D323-V350 WeakPolarHBondContact OD1-CA 3.27Å; W345-V350 HydrophobicContact CH2-CG2 3.88Å; W345-V350 HydrophobicContact CZ2-CG2 3.74Å; E347-V350 WeakPolarHBondContact O-CB 3.41Å; E347-V350 PolarHBondContact O-N 3.35Å; E347-V350 VanDerWaalsContact O-N 3.16Å
351	G	80.5	Confident	79.1	Confident	19 Å²	19	74 Å²	74	20%	0.196	40%	0.4	C	S	.	.	T	Hydrogen-bonded Turn	trans	87.9	9.8	-176.9	0	0	0	0	0	114.3	D323 V349 H353 T354 M355	D323-G351 VanDerWaalsContact CG-N 3.26Å; D323-G351 PolarHBondContact OD1-N 3.4Å; D323-G351 WeakPolarHBondContact OD2-CA 3.4Å; D323-G351 PolarHBondContact OD2-N 3.37Å; V349-G351 PolarHBondContact O-N 3.26Å; G351-H353 VanDerWaalsContact C-N 3.28Å; G351-H353 PolarHBondContact O-N 3.08Å; G351-T354 WeakPolarHBondContact O-CB 3.2Å; G351-T354 PolarHBondContact O-N 3.33Å; G351-T354 VanDerWaalsContact O-N 3.14Å; G351-M355 WeakPolarHBondContact O-CG 3.43Å; G351-M355 PolarHBondContact O-N 3.27Å
352	W	82.3	Confident	79.1	Confident	43 Å²	43	75.2 Å²	75.2	16%	0.163	40%	0.403	C	S	.	.	H	α-helix	trans	-64.2	-33.6	-176.2	74.1	-89	0	0	0	112.4	T267 I320 D323 V349 T354 M355 V356	T267-W352 HydrophobicContact CG2-CB 3.87Å; T267-W352 HydrophobicContact CG2-CD2 4.22Å; T267-W352 HydrophobicContact CG2-CG 3.84Å; I320-W352 PolarHBondContact O-NE1 3.32Å; D323-W352 PolarHBondContact OD2-N 2.89Å; V349-W352 WeakPolarHBondContact O-CB 3.38Å; V349-W352 VanDerWaalsContact O-CD1 3.27Å; V349-W352 PolarHBondContact O-N 3.03Å; W352-T354 VanDerWaalsContact C-N 3.31Å; W352-T354 PolarHBondContact O-N 3.23Å; W352-M355 PolarHBondContact O-N 2.97Å; W352-V356 HydrophobicContact CE3-CG2 3.94Å; W352-V356 HydrophobicContact CZ3-CG2 4.28Å; W352-V356 WeakPolarHBondContact O-CG2 3.34Å; W352-V356 PolarHBondContact O-N 2.97Å
353	H	79.5	Confident	78.6	Confident	74 Å²	74	80.9 Å²	80.9	34%	0.343	43%	0.431	S	S	.	.	H	α-helix	trans	-62	-41.3	175	-90	-66.8	0	0	0	111.4	G351 N357	G351-H353 VanDerWaalsContact C-N 3.28Å; G351-H353 PolarHBondContact O-N 3.08Å; H353-N357 PolarHBondContact O-N 3.06Å; H353-N357 PolarHBondContact O-ND2 3.24Å
354	T	79.6	Confident	78.3	Confident	94 Å²	94	79 Å²	79	58%	0.577	43%	0.428	S	S	*	.	H	α-helix	trans	-63.3	-44.4	174.5	-52.5	0	0	0	0	110.5	G351 W352 N357 T358	G351-T354 WeakPolarHBondContact O-CB 3.2Å; G351-T354 PolarHBondContact O-N 3.33Å; G351-T354 VanDerWaalsContact O-N 3.14Å; W352-T354 VanDerWaalsContact C-N 3.31Å; W352-T354 PolarHBondContact O-N 3.23Å; T354-N357 CarbonylContact O-C 3.6Å; T354-N357 PolarHBondContact O-N 3.28Å; T354-T358 PolarHBondContact O-N 3.17Å; T354-T358 PolarHBondContact O-OG1 3.32Å
355	M	81.2	Confident	77.6	Confident	10 Å²	10	84.7 Å²	84.7	5%	0.049	46%	0.463	C	S	.	.	H	α-helix	trans	-62.6	-46.1	-178.9	-68.1	168.7	67.7	0	0	113.4	Y260 R263 L264 G351 W352 N357 T358	Y260-M355 HydrophobicContact CD1-CB 4.2Å; Y260-M355 HydrophobicContact CD1-CE 4.26Å; Y260-M355 HydrophobicContact CD1-CG 4.11Å; Y260-M355 HydrophobicContact CE1-CB 4.33Å; Y260-M355 HydrophobicContact CE1-CG 3.99Å; Y260-M355 HydrophobicContact CG-CE 4.12Å; Y260-M355 WeakPolarHBondContact O-CE 3.39Å; R263-M355 HydrophobicContact CB-CE 3.35Å; R263-M355 HydrophobicContact CB-SD 4.16Å; R263-M355 HydrophobicContact CG-CE 4.38Å; R263-M355 PolarHBondContact NH1-SD 3.23Å; R263-M355 PolarHBondContact NH2-SD 2.89Å; L264-M355 HydrophobicContact CD2-CB 3.99Å; L264-M355 HydrophobicContact CD2-CE 4.16Å; L264-M355 HydrophobicContact CG-CB 4.46Å; L264-M355 HydrophobicContact CG-CE 3.82Å; G351-M355 WeakPolarHBondContact O-CG 3.43Å; G351-M355 PolarHBondContact O-N 3.27Å; W352-M355 PolarHBondContact O-N 2.97Å; M355-N357 PolarHBondContact O-N 3.44Å; M355-T358 WeakPolarHBondContact O-CB 3.39Å; M355-T358 PolarHBondContact O-N 2.86Å
356	V	80.2	Confident	76.9	Confident	69 Å²	69	89.1 Å²	89.1	42%	0.418	48%	0.48	S	S	.	.	H	α-helix	trans	-59.4	-34.2	178.1	171.5	0	0	0	0	111.5	L264 W352 R359	L264-V356 HydrophobicContact CD2-CG2 3.63Å; W352-V356 HydrophobicContact CE3-CG2 3.94Å; W352-V356 HydrophobicContact CZ3-CG2 4.28Å; W352-V356 WeakPolarHBondContact O-CG2 3.34Å; W352-V356 PolarHBondContact O-N 2.97Å; V356-R359 PolarHBondContact O-NH1 3.45Å
357	N	80.6	Confident	76.5	Confident	115 Å²	115	91.4 Å²	91.4	62%	0.615	49%	0.488	S	S	*	.	H	α-helix	trans	-90.9	-1.6	179.4	-66.9	-53.4	0	0	0	113.8	H353 T354 M355	H353-N357 PolarHBondContact O-N 3.06Å; H353-N357 PolarHBondContact O-ND2 3.24Å; T354-N357 CarbonylContact O-C 3.6Å; T354-N357 PolarHBondContact O-N 3.28Å; M355-N357 PolarHBondContact O-N 3.44Å
358	T	79.7	Confident	76.3	Confident	57 Å²	57	87 Å²	87	35%	0.35	48%	0.479	S	S	.	.			trans	-75.7	144.3	177.7	-61.1	0	0	0	0	110.5	Y260 T354 M355	Y260-T358 HydrophobicContact CE1-CG2 3.95Å; T354-T358 PolarHBondContact O-N 3.17Å; T354-T358 PolarHBondContact O-OG1 3.32Å; M355-T358 WeakPolarHBondContact O-CB 3.39Å; M355-T358 PolarHBondContact O-N 2.86Å
359	R	79.2	Confident	75.9	Confident	184 Å²	184	88.7 Å²	88.7	69%	0.694	49%	0.485	S	S	*	.			trans	-131.9	138.8	176.7	-61.9	-67.1	178.6	-103.8	2.2	109.5	V356	V356-R359 PolarHBondContact O-NH1 3.45Å
360	A	76.5	Confident	75.4	Confident	80 Å²	80	91.8 Å²	91.8	66%	0.661	50%	0.499	S	S	*	.			trans	-87.5	134.1	170.6	0	0	0	0	0	109.7	L253	L253-A360 HydrophobicContact CD1-CB 4.08Å
361	L	70.9	Confident	75	Confident	147 Å²	147	93.9 Å²	93.9	77%	0.77	51%	0.508	S	S	*	.			trans	-132	134.9	178.3	-64.6	171.3	0	0	0	108.9
362	F	79.3	Confident	74.8	Confident	181 Å²	181	97.3 Å²	97.3	79%	0.794	53%	0.528	S	S	*	.			trans	-99.2	121.1	170	175.8	-109.2	0	0	0	109.1
363	L	68.1	Low	74.3	Confident	140 Å²	140	103.4 Å²	103.4	73%	0.733	55%	0.551	S	S	*	*			trans	-109	102.3	178.8	-60.9	174.5	0	0	0	108.8	T365	L363-T365 PolarHBondContact O-N 3.33Å
364	G	71.7	Confident	73.9	Confident	62 Å²	62	105.8 Å²	105.8	64%	0.639	56%	0.558	S	S	*	*			trans	-79.4	105.5	169.2	0	0	0	0	0	109.6
365	T	65.1	Low	73.7	Confident	122 Å²	122	103.1 Å²	103.1	75%	0.748	54%	0.543	S	S	*	.			trans	-86.5	-12	-172.7	47.3	0	0	0	0	114.7	L363	L363-T365 PolarHBondContact O-N 3.33Å
366	W	65.1	Low	73.5	Confident	138 Å²	138	105.4 Å²	105.4	52%	0.523	57%	0.569	S	S	.	*	S	Bend	trans	-122.1	140.6	-174.3	-65.2	80.6	0	0	0	111.4	L371	W366-L371 HydrophobicContact CB-CD1 3.57Å; W366-L371 HydrophobicContact CB-CD2 4.18Å; W366-L371 HydrophobicContact CB-CG 3.77Å; W366-L371 HydrophobicContact CD2-CD2 4.01Å; W366-L371 HydrophobicContact CD2-CG 4.48Å; W366-L371 HydrophobicContact CE3-CD2 3.92Å; W366-L371 HydrophobicContact CE3-CG 4.37Å; W366-L371 HydrophobicContact CG-CD1 4.26Å; W366-L371 HydrophobicContact CG-CD2 4.14Å; W366-L371 HydrophobicContact CG-CG 4.27Å
367	D	71.3	Confident	73.6	Confident	92 Å²	92	108.6 Å²	108.6	49%	0.492	59%	0.589	S	S	.	*			trans	-68.5	136.4	166.5	178.7	70.6	0	0	0	110.3	E369 E370 L371	D367-E369 VanDerWaalsContact C-N 3.31Å; D367-E369 PolarHBondContact O-N 2.83Å; D367-E369 WeakPolarHBondContact OD2-CA 3.49Å; D367-E369 WeakPolarHBondContact OD2-CB 3.31Å; D367-E369 PolarHBondContact OD2-N 2.88Å; D367-E370 HydrophobicContact CB-CB 4.07Å; D367-E370 PolarHBondContact O-N 3.23Å; D367-E370 PolarHBondContact OD2-N 3.01Å; D367-L371 PolarHBondContact O-N 3.15Å; D367-L371 VanDerWaalsContact O-N 3.15Å
368	A	73.2	Confident	73.7	Confident	69 Å²	69	108.6 Å²	108.6	57%	0.57	59%	0.588	S	S	*	*	H	α-helix	trans	-68.2	-33.7	-175.5	0	0	0	0	0	112	C372	A368-C372 PolarHBondContact O-N 3.21Å; A368-C372 PolarHBondContact O-SG 3.05Å
369	E	70.6	Confident	73.6	Confident	120 Å²	120	109.2 Å²	109.2	56%	0.561	60%	0.599	S	S	*	*	H	α-helix	trans	-71.2	-40	179.3	-160.8	-175.8	147.1	0	0	110.7	D367 C372 R373	D367-E369 VanDerWaalsContact C-N 3.31Å; D367-E369 PolarHBondContact O-N 2.83Å; D367-E369 WeakPolarHBondContact OD2-CA 3.49Å; D367-E369 WeakPolarHBondContact OD2-CB 3.31Å; D367-E369 PolarHBondContact OD2-N 2.88Å; E369-C372 WeakPolarHBondContact O-CB 3.1Å; E369-C372 PolarHBondContact O-N 3.06Å; E369-R373 PolarHBondContact O-N 2.78Å; E369-R373 IonicContact OE1-CZ 3.6Å; E369-R373 IonicContact OE1-NE 2.82Å; E369-R373 IonicContact OE1-NH2 3.65Å; E369-R373 PolarHBondContact OE1-NH2 3.48Å
370	E	68.3	Low	73.6	Confident	67 Å²	67	108.8 Å²	108.8	31%	0.313	60%	0.598	S	S	.	*	H	α-helix	trans	-62.7	-45.7	176.5	-171.1	168.5	-156	0	0	112.2	D367 C372 R373 Y374 V462	D367-E370 HydrophobicContact CB-CB 4.07Å; D367-E370 PolarHBondContact O-N 3.23Å; D367-E370 PolarHBondContact OD2-N 3.01Å; E370-C372 VanDerWaalsContact C-N 3.26Å; E370-C372 PolarHBondContact O-N 3.21Å; E370-R373 PolarHBondContact O-N 2.82Å; E370-R373 VanDerWaalsContact O-N 3.13Å; E370-Y374 HydrophobicContact CG-CD2 4.15Å; E370-Y374 HydrophobicContact CG-CE2 3.72Å; E370-Y374 WeakPolarHBondContact O-CD2 3.34Å; E370-Y374 PolarHBondContact O-N 3.37Å; E370-Y374 VanDerWaalsContact O-N 3.17Å; E370-V462 WeakPolarHBondContact OE1-CG2 3.38Å
371	L	73	Confident	73.3	Confident	88 Å²	88	111.4 Å²	111.4	46%	0.461	60%	0.6	S	S	.	*	H	α-helix	trans	-58.4	-37.9	172.8	-76.1	171.2	0	0	0	112.5	W366 D367 Y374 S375	W366-L371 HydrophobicContact CB-CD1 3.57Å; W366-L371 HydrophobicContact CB-CD2 4.18Å; W366-L371 HydrophobicContact CB-CG 3.77Å; W366-L371 HydrophobicContact CD2-CD2 4.01Å; W366-L371 HydrophobicContact CD2-CG 4.48Å; W366-L371 HydrophobicContact CE3-CD2 3.92Å; W366-L371 HydrophobicContact CE3-CG 4.37Å; W366-L371 HydrophobicContact CG-CD1 4.26Å; W366-L371 HydrophobicContact CG-CD2 4.14Å; W366-L371 HydrophobicContact CG-CG 4.27Å; D367-L371 PolarHBondContact O-N 3.15Å; D367-L371 VanDerWaalsContact O-N 3.15Å; L371-Y374 PolarHBondContact O-N 3.39Å; L371-S375 PolarHBondContact O-N 3.04Å
372	C	75.8	Confident	73.3	Confident	91 Å²	91	110 Å²	110	62%	0.615	60%	0.599	S	S	*	*	H	α-helix	trans	-65.9	-38.9	177.1	-70.3	0	0	0	0	111.8	A368 E369 E370 Y374 S375	A368-C372 PolarHBondContact O-N 3.21Å; A368-C372 PolarHBondContact O-SG 3.05Å; E369-C372 WeakPolarHBondContact O-CB 3.1Å; E369-C372 PolarHBondContact O-N 3.06Å; E370-C372 VanDerWaalsContact C-N 3.26Å; E370-C372 PolarHBondContact O-N 3.21Å; C372-Y374 VanDerWaalsContact C-N 3.31Å; C372-Y374 PolarHBondContact O-N 2.75Å; C372-S375 WeakPolarHBondContact O-CB 3.48Å; C372-S375 PolarHBondContact O-N 3.01Å
373	R	71.2	Confident	72.5	Confident	172 Å²	172	108.5 Å²	108.5	65%	0.649	59%	0.593	S	S	*	*	H	α-helix	trans	-63.7	-37.2	176.1	-69.1	-178.8	-167.8	170.1	5.8	112	E369 E370 S375	E369-R373 PolarHBondContact O-N 2.78Å; E369-R373 IonicContact OE1-CZ 3.6Å; E369-R373 IonicContact OE1-NE 2.82Å; E369-R373 IonicContact OE1-NH2 3.65Å; E369-R373 PolarHBondContact OE1-NH2 3.48Å; E370-R373 PolarHBondContact O-N 2.82Å; E370-R373 VanDerWaalsContact O-N 3.13Å; R373-S375 PolarHBondContact O-N 2.98Å
374	Y	70.7	Confident	71.9	Confident	123 Å²	123	110.6 Å²	110.6	48%	0.482	60%	0.598	S	S	.	*	T	Hydrogen-bonded Turn	trans	-69.3	-10.8	173.6	-73.7	-63.5	0	0	0	114.2	E370 L371 C372 G376 V462	E370-Y374 HydrophobicContact CG-CD2 4.15Å; E370-Y374 HydrophobicContact CG-CE2 3.72Å; E370-Y374 WeakPolarHBondContact O-CD2 3.34Å; E370-Y374 PolarHBondContact O-N 3.37Å; E370-Y374 VanDerWaalsContact O-N 3.17Å; L371-Y374 PolarHBondContact O-N 3.39Å; C372-Y374 VanDerWaalsContact C-N 3.31Å; C372-Y374 PolarHBondContact O-N 2.75Å; Y374-G376 VanDerWaalsContact C-N 3.3Å; Y374-G376 PolarHBondContact O-N 3.44Å; Y374-V462 WeakPolarHBondContact OH-CG2 3.27Å
375	S	76.4	Confident	70.9	Confident	39 Å²	39	111.5 Å²	111.5	27%	0.273	60%	0.6	S	S	.	*	T	Hydrogen-bonded Turn	trans	-67.2	-27.9	-179.7	-177.6	0	0	0	0	113.3	L238 L371 C372 R373	L238-S375 WeakPolarHBondContact CD1-OG 3.37Å; L371-S375 PolarHBondContact O-N 3.04Å; C372-S375 WeakPolarHBondContact O-CB 3.48Å; C372-S375 PolarHBondContact O-N 3.01Å; R373-S375 PolarHBondContact O-N 2.98Å
376	G	77.3	Confident	70.1	Confident	58 Å²	58	114.6 Å²	114.6	60%	0.598	60%	0.603	S	S	*	*			trans	164.5	158.9	176.8	0	0	0	0	0	115.2	Y374	Y374-G376 VanDerWaalsContact C-N 3.3Å; Y374-G376 PolarHBondContact O-N 3.44Å
377	T	81.6	Confident	68.9	Low	136 Å²	136	114.5 Å²	114.5	83%	0.834	61%	0.613	S	S	*	*			trans	-133.1	150	177.4	51.9	0	0	0	0	110.6
378	I	82	Confident	67.5	Low	114 Å²	114	116 Å²	116	59%	0.585	63%	0.626	S	S	*	*			trans	-96.4	114.9	175.9	-59.7	175.3	0	0	0	108.3	I231 W380	I231-I378 HydrophobicContact CD1-CD1 4.14Å; I231-I378 HydrophobicContact CD1-CG1 4.43Å; I378-W380 HydrophobicContact CG2-CD2 4.48Å; I378-W380 HydrophobicContact CG2-CZ2 4.04Å
379	A	78.7	Confident	66	Low	71 Å²	71	119.4 Å²	119.4	59%	0.587	63%	0.628	S	S	*	*			trans	-99.8	130.7	172.5	0	0	0	0	0	110.7
380	W	78.6	Confident	64.4	Low	175 Å²	175	118.1 Å²	118.1	66%	0.663	63%	0.632	S	S	*	*			trans	-100.2	101.1	175.6	-60.7	95.7	0	0	0	109.4	F220 V224 I378	F220-W380 HydrophobicContact CE2-CE3 4.14Å; F220-W380 AromaticContact CE2-CZ3 3.7Å; F220-W380 HydrophobicContact CE2-CZ3 3.7Å; F220-W380 HydrophobicContact CZ-CH2 4.49Å; F220-W380 AromaticContact CZ-CZ3 3.78Å; F220-W380 HydrophobicContact CZ-CZ3 3.78Å; V224-W380 HydrophobicContact CG2-CH2 4.34Å; V224-W380 HydrophobicContact CG2-CZ3 4.18Å; I378-W380 HydrophobicContact CG2-CD2 4.48Å; I378-W380 HydrophobicContact CG2-CZ2 4.04Å
381	L	71.5	Confident	63	Low	134 Å²	134	121.3 Å²	121.3	70%	0.702	65%	0.65	S	S	*	*	P	Polyproline II helix	trans	-97.4	128.4	-178.4	-66.1	167.1	0	0	0	110.6	K383	L381-K383 PolarHBondContact O-N 3.23Å
382	P	69.1	Low	60.9	Low	117 Å²	117	126.4 Å²	126.4	76%	0.76	67%	0.669	S	S	*	*	P	Polyproline II helix	trans	-65.1	134.3	171.6	26.1	-31.2	0	0	0	109.9	Q384	P382-Q384 PolarHBondContact O-N 2.91Å
383	K	63.4	Low	59	Low	151 Å²	151	128.6 Å²	128.6	66%	0.657	67%	0.674	S	S	*	*	P	Polyproline II helix	trans	-65.5	121.6	169.3	-169.5	172.2	-172.4	168.5	0	107.3	D218 L381 A385	D218-K383 IonicContact OD2-NZ 2.99Å; D218-K383 PolarHBondContact OD2-NZ 3.06Å; L381-K383 PolarHBondContact O-N 3.23Å; K383-A385 PolarHBondContact O-N 3.1Å
384	Q	54.6	Low	56.9	Low	183 Å²	183	126.7 Å²	126.7	86%	0.855	68%	0.677	S	S	*	*			trans	-59	107.7	171.6	-71.6	-167.9	-9.4	0	0	108.4	P382 K386	P382-Q384 PolarHBondContact O-N 2.91Å; Q384-K386 PolarHBondContact O-N 3.2Å
385	A	51.5	Low	54.9	Low	81 Å²	81	127.2 Å²	127.2	67%	0.669	69%	0.688	S	S	*	*			trans	-64.6	120.2	170	0	0	0	0	0	106.9	K383 N387	K383-A385 PolarHBondContact O-N 3.1Å; A385-N387 PolarHBondContact O-N 2.9Å
386	K	49	Very low	52.6	Low	188 Å²	188	134 Å²	134	82%	0.817	72%	0.716	S	S	*	*			trans	-58.3	110.5	157.8	-70.8	179.5	-179.4	176.1	0	104.8	Q384 T388	Q384-K386 PolarHBondContact O-N 3.2Å; K386-T388 VanDerWaalsContact C-N 3.25Å; K386-T388 PolarHBondContact O-N 3.31Å; K386-T388 PolarHBondContact O-OG1 2.99Å
387	N	40.2	Very low	50	Low	135 Å²	135	137.5 Å²	137.5	72%	0.722	73%	0.726	S	S	*	*			trans	-51.2	93.2	176.4	-95.3	-10.6	0	0	0	108.9	A385	A385-N387 PolarHBondContact O-N 2.9Å
388	T	40.2	Very low	47.4	Very low	125 Å²	125	140.9 Å²	140.9	77%	0.767	73%	0.729	S	S	*	*			trans	-93.5	13.1	172.9	-34.8	0	0	0	0	109.6	K386	K386-T388 VanDerWaalsContact C-N 3.25Å; K386-T388 PolarHBondContact O-N 3.31Å; K386-T388 PolarHBondContact O-OG1 2.99Å
389	F	43.1	Very low	44.4	Very low	139 Å²	139	138.6 Å²	138.6	61%	0.61	73%	0.734	S	S	*	*			trans	-123.5	48.3	174.3	-64.9	-77.2	0	0	0	110.5
390	S	36.7	Very low	41.9	Very low	94 Å²	94	141.2 Å²	141.2	66%	0.657	75%	0.748	S	S	*	*			trans	-89.9	109.1	165.9	-79	0	0	0	0	109.9	K392	S390-K392 PolarHBondContact O-N 3.27Å
391	L	37.9	Very low	39.3	Very low	133 Å²	133	141.6 Å²	141.6	70%	0.696	76%	0.757	S	S	*	*			trans	-49.9	124.1	163.9	-85.8	81	0	0	0	109.7	D393	L391-D393 WeakPolarHBondContact CD2-OD2 3.4Å; L391-D393 PolarHBondContact O-N 3.09Å
392	K	30.7	Very low	36.9	Very low	195 Å²	195	141.7 Å²	141.7	85%	0.848	76%	0.763	S	S	*	*			trans	-87.8	85.5	153.4	-78.9	-173.2	176.2	-178.6	0	107.2	S390 N394	S390-K392 PolarHBondContact O-N 3.27Å; K392-N394 PolarHBondContact O-N 2.87Å
393	D	34.5	Very low	34.7	Very low	137 Å²	137	140.8 Å²	140.8	73%	0.733	77%	0.765	S	S	*	*			trans	-72	97.6	164.7	-79.2	-29.9	0	0	0	108.5	L391	L391-D393 WeakPolarHBondContact CD2-OD2 3.4Å; L391-D393 PolarHBondContact O-N 3.09Å
394	N	28.2	Very low	32.9	Very low	132 Å²	132	139.8 Å²	139.8	71%	0.706	77%	0.772	S	S	*	*			trans	-73.2	130.6	162.8	-80.7	-24.7	0	0	0	108.8	K392	K392-N394 PolarHBondContact O-N 2.87Å
395	N	27.8	Very low	31.3	Very low	134 Å²	134	140.1 Å²	140.1	72%	0.717	77%	0.77	S	S	*	*			trans	71.2	108.5	147.4	-61.8	-16.4	0	0	0	118.2
396	Q	29.4	Very low	30	Very low	182 Å²	182	141.9 Å²	141.9	85%	0.85	77%	0.773	S	S	*	*				172.7	122	90.4	-105.9	160.4	39	0	0	112.8
397	T	22.7	Very low	28.7	Very low	131 Å²	131	140.8 Å²	140.8	80%	0.804	77%	0.771	S	S	*	*			trans	-58.7	124.6	162.6	-36.1	0	0	0	0	111.4
398	F	25.8	Very low	27.9	Very low	207 Å²	207	142.1 Å²	142.1	91%	0.908	78%	0.778	S	S	*	*			trans	-151.4	109.7	146.3	-112.7	-81	0	0	0	109
399	G	19.8	Very low	27.3	Very low	67 Å²	67	139.9 Å²	139.9	69%	0.691	78%	0.78	S	S	*	*			trans	-79.2	150.1	165.8	0	0	0	0	0	110.8
400	S	26.3	Very low	26.3	Very low	125 Å²	125	140.7 Å²	140.7	87%	0.874	79%	0.789	S	S	*	*				-166.6	138.4	125.3	-154.9	0	0	0	0	110.3
401	Q	22.2	Very low	25.8	Very low	184 Å²	184	144.3 Å²	144.3	86%	0.86	80%	0.8	S	S	*	*			trans	-67.3	138.5	177.4	-63.4	160.9	-14.3	0	0	111.3
402	V	23	Very low	25.1	Very low	136 Å²	136	146.8 Å²	146.8	82%	0.824	81%	0.805	S	S	*	*			trans	-146.2	122.3	140.6	179.8	0	0	0	0	108.6	V404	V402-V404 HydrophobicContact CG1-CG2 4.21Å
403	A	21.5	Very low	24.7	Very low	97 Å²	97	144.6 Å²	144.6	80%	0.802	80%	0.803	S	S	*	*			trans	-95	133.3	168.8	0	0	0	0	0	109.5
404	V	25	Very low	24.2	Very low	131 Å²	131	144.6 Å²	144.6	79%	0.794	80%	0.803	S	S	*	*			trans	-139.6	125.3	160.5	178.3	0	0	0	0	109	V402	V402-V404 HydrophobicContact CG1-CG2 4.21Å
405	K	21.4	Very low	24	Very low	189 Å²	189	144.7 Å²	144.7	82%	0.822	80%	0.804	S	S	*	*			trans	-79.1	145.9	169.8	-66.3	171.3	171.9	178.8	0	109.8
406	T	24.1	Very low	24	Very low	119 Å²	119	147.6 Å²	147.6	73%	0.73	81%	0.81	S	S	*	*				175.3	119.8	127.4	24.2	0	0	0	0	113.3
407	E	22.5	Very low	23.8	Very low	165 Å²	165	143.4 Å²	143.4	77%	0.771	81%	0.807	S	S	*	*				52.5	116.5	125.6	-60.5	176.6	-166.1	0	0	122.2
408	N	24	Very low	24	Very low	163 Å²	163	142.5 Å²	142.5	87%	0.872	81%	0.806	S	S	*	*			trans	59.8	108.8	136.6	-58.5	-15.5	0	0	0	120.2
409	G	26.8	Very low	24	Very low	78 Å²	78	139 Å²	139	80%	0.804	80%	0.797	S	S	*	*			trans	151.7	90.5	153.1	0	0	0	0	0	115.6
410	L	21.5	Very low	24.3	Very low	155 Å²	155	145.1 Å²	145.1	81%	0.812	81%	0.807	S	S	*	*			trans	-8.2	117	157.3	-158.9	85.3	0	0	0	117
411	L	27	Very low	24.4	Very low	170 Å²	170	147 Å²	147	89%	0.89	80%	0.8	S	S	*	*				-167.5	119.7	126.9	-99	165	0	0	0	109.2
412	K	22.6	Very low	24.7	Very low	185 Å²	185	142.9 Å²	142.9	80%	0.804	79%	0.792	S	S	*	*			trans	-69	124	178.1	-66.7	172.2	174.1	-179.7	0	109.4
413	N	23	Very low	25	Very low	149 Å²	149	140.7 Å²	140.7	80%	0.797	79%	0.787	S	S	*	*			trans	-171.7	123.3	140.9	-93.6	-13.1	0	0	0	109.3
414	N	24.1	Very low	25.4	Very low	137 Å²	137	142 Å²	142	73%	0.733	78%	0.781	S	S	*	*			trans	34.2	103.8	141.7	-64.2	2.4	0	0	0	117.2
415	D	24.5	Very low	25.8	Very low	134 Å²	134	141.9 Å²	141.9	72%	0.717	78%	0.781	S	S	*	*				159.4	147.4	104.1	-79.9	-31	0	0	0	111.1
416	F	26.1	Very low	26.2	Very low	195 Å²	195	139.2 Å²	139.2	86%	0.855	78%	0.776	S	S	*	*			trans	70.9	90.5	167.2	-64.1	-78.1	0	0	0	118.7
417	A	26.4	Very low	26.9	Very low	94 Å²	94	138.9 Å²	138.9	78%	0.777	77%	0.769	S	S	*	*			trans	-119.9	111.2	139.7	0	0	0	0	0	108.8	N419	A417-N419 PolarHBondContact O-N 3.24Å
418	S	25.9	Very low	27.4	Very low	113 Å²	113	137.3 Å²	137.3	79%	0.79	76%	0.76	S	S	*	*			trans	-52.1	103.6	171.3	-50.5	0	0	0	0	110.9
419	N	26.5	Very low	27.8	Very low	133 Å²	133	136.2 Å²	136.2	71%	0.711	75%	0.753	S	S	*	*			trans	-106.3	101.5	166.1	-101.1	-7.2	0	0	0	108	A417 F421	A417-N419 PolarHBondContact O-N 3.24Å; N419-F421 HydrophobicContact CB-CD2 3.97Å; N419-F421 HydrophobicContact CB-CE2 4.49Å; N419-F421 PolarHBondContact O-N 3.26Å; N419-F421 VanDerWaalsContact O-N 3.11Å
420	Q	26.9	Very low	28.1	Very low	195 Å²	195	137.8 Å²	137.8	91%	0.911	74%	0.744	S	S	*	*			trans	-65.1	98.5	158.1	-68.7	177.7	3.3	0	0	106.9
421	F	27.5	Very low	28.8	Very low	165 Å²	165	133.1 Å²	133.1	72%	0.724	72%	0.724	S	S	*	*			trans	-123.2	123.8	165.3	-89.7	-83.2	0	0	0	110.4	N419	N419-F421 HydrophobicContact CB-CD2 3.97Å; N419-F421 HydrophobicContact CB-CE2 4.49Å; N419-F421 PolarHBondContact O-N 3.26Å; N419-F421 VanDerWaalsContact O-N 3.11Å
422	S	28.5	Very low	28.8	Very low	98 Å²	98	130.3 Å²	130.3	69%	0.685	71%	0.709	S	S	*	*			trans	-65.3	129.2	-179.4	144.8	0	0	0	0	110.9	D424	S422-D424 PolarHBondContact O-N 3.33Å
423	A	29.2	Very low	29.4	Very low	89 Å²	89	125.2 Å²	125.2	74%	0.736	70%	0.701	S	S	*	*			trans	31.6	58.5	145.6	0	0	0	0	0	117.7	T425	A423-T425 PolarHBondContact O-N 3.21Å
424	D	29.3	Very low	29.9	Very low	126 Å²	126	125.8 Å²	125.8	67%	0.674	70%	0.699	S	S	*	*			trans	-91	91.1	163.4	-77.4	-36.1	0	0	0	108.9	S422	S422-D424 PolarHBondContact O-N 3.33Å
425	T	33.1	Very low	30.3	Very low	128 Å²	128	126.3 Å²	126.3	79%	0.785	70%	0.701	S	S	*	*			trans	-108.9	43.5	163.3	51.4	0	0	0	0	110.3	A423	A423-T425 PolarHBondContact O-N 3.21Å
426	N	31.7	Very low	30.8	Very low	133 Å²	133	127.7 Å²	127.7	71%	0.711	71%	0.708	S	S	*	*			trans	-98.3	3	168.1	-71.6	-28.2	0	0	0	112.6	F428	N426-F428 VanDerWaalsContact C-N 3.3Å; N426-F428 PolarHBondContact O-N 3.08Å
427	D	37.8	Very low	31.1	Very low	112 Å²	112	120.9 Å²	120.9	60%	0.599	69%	0.694	S	S	*	*	H	α-helix	trans	-80.8	2.4	-169.2	-153.4	21.6	0	0	0	115.3	S431	D427-S431 PolarHBondContact O-OG 3.35Å; D427-S431 VanDerWaalsContact O-OG 3.13Å
428	F	33	Very low	31.2	Very low	132 Å²	132	123.5 Å²	123.5	58%	0.579	70%	0.695	S	S	*	*	H	α-helix	trans	-85	-27.8	178	-169.9	-101.7	0	0	0	113.1	N426 L432	N426-F428 VanDerWaalsContact C-N 3.3Å; N426-F428 PolarHBondContact O-N 3.08Å; F428-L432 HydrophobicContact CE1-CD1 4.36Å
429	L	32.5	Very low	31.1	Very low	139 Å²	139	129.3 Å²	129.3	73%	0.728	70%	0.699	S	S	*	*	H	α-helix	trans	-77.5	-30.8	177.9	-75.6	168.9	0	0	0	111.9	S431 L432	L429-S431 VanDerWaalsContact C-N 3.33Å; L429-L432 PolarHBondContact O-N 3.24Å
430	D	34	Very low	31.2	Very low	112 Å²	112	134.7 Å²	134.7	60%	0.599	71%	0.71	S	S	*	*	H	α-helix	trans	-68.5	-32.7	173.4	-77.6	-18.8	0	0	0	112	L432 A433	D430-L432 VanDerWaalsContact C-N 3.25Å; D430-L432 PolarHBondContact O-N 3.27Å; D430-A433 WeakPolarHBondContact O-CB 3.45Å; D430-A433 PolarHBondContact O-N 2.98Å; D430-A433 VanDerWaalsContact O-N 3.15Å
431	S	34.5	Very low	30.9	Very low	56 Å²	56	131.6 Å²	131.6	39%	0.392	70%	0.704	S	S	.	*	H	α-helix	trans	-67.5	-21.5	177.5	-65.1	0	0	0	0	114.1	D427 L429	D427-S431 PolarHBondContact O-OG 3.35Å; D427-S431 VanDerWaalsContact O-OG 3.13Å; L429-S431 VanDerWaalsContact C-N 3.33Å
432	L	28.2	Very low	30.9	Very low	112 Å²	112	129.3 Å²	129.3	59%	0.586	71%	0.708	S	S	*	*	H	α-helix	trans	-79	-22.7	176.2	-115.5	143.9	0	0	0	112	F428 L429 D430	F428-L432 HydrophobicContact CE1-CD1 4.36Å; L429-L432 PolarHBondContact O-N 3.24Å; D430-L432 VanDerWaalsContact C-N 3.25Å; D430-L432 PolarHBondContact O-N 3.27Å
433	A	33.6	Very low	30.6	Very low	77 Å²	77	128.4 Å²	128.4	64%	0.636	71%	0.713	S	S	*	*	H	α-helix	trans	-77	-25.8	174.6	0	0	0	0	0	112.8	D430	D430-A433 WeakPolarHBondContact O-CB 3.45Å; D430-A433 PolarHBondContact O-N 2.98Å; D430-A433 VanDerWaalsContact O-N 3.15Å
434	E	35.5	Very low	30.4	Very low	161 Å²	161	133.8 Å²	133.8	75%	0.752	72%	0.723	S	S	*	*	H	α-helix	trans	-82	-21.1	179.6	-73.5	-169.4	159.7	0	0	114	D436 G437	E434-D436 PolarHBondContact O-N 3.29Å; E434-G437 PolarHBondContact O-N 3.45Å
435	L	32.1	Very low	30.4	Very low	148 Å²	148	131.9 Å²	131.9	78%	0.775	73%	0.725	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.5	-14.2	-176.3	-86.6	158.4	0	0	0	114.8
436	D	33.4	Very low	30.1	Very low	163 Å²	163	133.5 Å²	133.5	87%	0.872	73%	0.729	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.4	9.3	172.1	-88.3	-18.5	0	0	0	113.3	E434	E434-D436 PolarHBondContact O-N 3.29Å
437	G	33.4	Very low	29.8	Very low	53 Å²	53	130.6 Å²	130.6	55%	0.546	73%	0.731	S	S	.	*	S	Bend	trans	-85	-30.1	-173.5	0	0	0	0	0	117.6	E434	E434-G437 PolarHBondContact O-N 3.45Å
438	D	27.7	Very low	29.4	Very low	149 Å²	149	133.7 Å²	133.7	80%	0.797	74%	0.742	S	S	*	*	S	Bend	trans	-138.8	79	-159.8	-83.6	-29.8	0	0	0	115.5
439	R	25.5	Very low	29.3	Very low	235 Å²	235	133 Å²	133	89%	0.887	75%	0.753	S	S	*	*				-178.8	71.2	129.4	-121.8	171.1	-73.7	-136.8	-4.8	113.4
440	W	27.4	Very low	29.2	Very low	245 Å²	245	131.9 Å²	131.9	93%	0.928	75%	0.748	S	S	*	*			trans	-127.9	102.5	147.2	-130.3	-33	0	0	0	109.4	C442	W440-C442 PolarHBondContact O-N 3.31Å; W440-C442 VanDerWaalsContact O-N 3.16Å
441	T	21.9	Very low	29.4	Very low	131 Å²	131	132 Å²	132	80%	0.804	76%	0.758	S	S	*	*			trans	-66.7	107.3	176.4	48.7	0	0	0	0	109.9
442	C	25.5	Very low	29.8	Very low	117 Å²	117	133.1 Å²	133.1	79%	0.791	77%	0.765	S	S	*	*			trans	-147.8	113.6	151.1	56.3	0	0	0	0	110.7	W440	W440-C442 PolarHBondContact O-N 3.31Å; W440-C442 VanDerWaalsContact O-N 3.16Å
443	G	23.3	Very low	30.8	Very low	78 Å²	78	131.8 Å²	131.8	80%	0.804	76%	0.762	S	S	*	*			trans	63	106.6	138.2	0	0	0	0	0	118.9	A445	G443-A445 PolarHBondContact O-N 2.79Å
444	E	24	Very low	32	Very low	203 Å²	203	134 Å²	134	95%	0.949	77%	0.767	S	S	*	*			trans	-14.2	119.3	148.8	-60.9	172.5	160	0	0	116.3
445	A	29.9	Very low	33.7	Very low	85 Å²	85	126.8 Å²	126.8	70%	0.702	74%	0.736	S	S	*	*				169.8	127.1	118.4	0	0	0	0	0	111.8	G443	G443-A445 PolarHBondContact O-N 2.79Å
446	N	27.2	Very low	35.9	Very low	162 Å²	162	119.8 Å²	119.8	87%	0.866	70%	0.699	S	S	*	*			trans	62.8	115.2	154.1	-62.8	-13.8	0	0	0	118.8
447	G	26	Very low	38.2	Very low	73 Å²	73	112.4 Å²	112.4	75%	0.753	66%	0.661	S	S	*	*			trans	-66.3	149.4	174.6	0	0	0	0	0	113.3
448	E	28.8	Very low	40.6	Very low	177 Å²	177	110.2 Å²	110.2	83%	0.827	64%	0.637	S	S	*	*			trans	-159.1	126.5	141.6	-106.5	165.8	-160.3	0	0	106.5	N450	E448-N450 PolarHBondContact O-N 3.11Å
449	S	30.6	Very low	42.9	Very low	117 Å²	117	104.9 Å²	104.9	82%	0.818	61%	0.611	S	S	*	*			trans	-58.8	98.5	179.9	49.1	0	0	0	0	111.2
450	N	30.9	Very low	45.1	Very low	116 Å²	116	98 Å²	98	62%	0.62	59%	0.587	S	S	*	*			trans	-132.9	103.4	165.3	-77.1	-38.5	0	0	0	108	E448 S452	E448-N450 PolarHBondContact O-N 3.11Å; N450-S452 PolarHBondContact O-N 3.3Å
451	S	37.7	Very low	46.8	Very low	115 Å²	115	87 Å²	87	80%	0.804	55%	0.55	S	S	*	*			trans	-61.8	80.9	162.4	175.7	0	0	0	0	108	T453	S451-T453 VanDerWaalsContact C-N 3.35Å; S451-T453 PolarHBondContact O-N 3.02Å; S451-T453 VanDerWaalsContact O-N 3.12Å
452	S	42.4	Very low	48.9	Very low	79 Å²	79	82.9 Å²	82.9	55%	0.552	53%	0.525	S	S	*	.			trans	-71.2	98.4	164.4	54.5	0	0	0	0	106	N450 V454	N450-S452 PolarHBondContact O-N 3.3Å; S452-V454 WeakPolarHBondContact O-CG2 3.49Å; S452-V454 PolarHBondContact O-N 3.37Å; S452-V454 VanDerWaalsContact O-N 3.09Å
453	T	49.2	Very low	50.9	Low	83 Å²	83	79.8 Å²	79.8	51%	0.509	51%	0.512	S	S	.	.			trans	-55.6	118.1	166.5	47.3	0	0	0	0	107.5	S451 G455	S451-T453 VanDerWaalsContact C-N 3.35Å; S451-T453 PolarHBondContact O-N 3.02Å; S451-T453 VanDerWaalsContact O-N 3.12Å; T453-G455 PolarHBondContact O-N 3.14Å
454	V	58.8	Low	53.2	Low	124 Å²	124	83 Å²	83	75%	0.752	51%	0.511	S	S	*	.	S	Bend	trans	-75	12.9	-167	-171.4	0	0	0	0	112.8	S452	S452-V454 WeakPolarHBondContact O-CG2 3.49Å; S452-V454 PolarHBondContact O-N 3.37Å; S452-V454 VanDerWaalsContact O-N 3.09Å
455	G	71.9	Confident	55.7	Low	10 Å²	10	74.7 Å²	74.7	10%	0.103	47%	0.473	C	S	.	.	S	Bend	trans	-139.7	171.5	-174.2	0	0	0	0	0	113.5	T453 A457 G461	T453-G455 PolarHBondContact O-N 3.14Å; G455-A457 PolarHBondContact O-N 3.22Å; G455-G461 WeakPolarHBondContact CA-O 3.45Å
456	C	78.8	Confident	57.8	Low	0 Å²	0	71 Å²	71	0%	0	44%	0.442	C	S	.	.	B	Isolated β-bridge	trans	-58.7	129	173.7	176.1	0	0	0	0	110.6	I458 F460 G461 L465 A474 H476 C479	C456-I458 PolarHBondContact O-N 3Å; C456-I458 PolarHBondContact SG-N 2.96Å; C456-F460 WeakPolarHBondContact O-CA 3.4Å; C456-F460 PolarHBondContact O-N 2.89Å; C456-G461 WeakPolarHBondContact CB-O 3.29Å; C456-G461 PolarHBondContact N-O 2.65Å; C456-L465 HydrophobicContact CB-CD2 3.74Å; C456-A474 CarbonylContact C-O 3.3Å; C456-A474 VanDerWaalsContact CA-O 3.27Å; C456-A474 WeakPolarHBondContact CA-O 3.14Å; C456-H476 VanDerWaalsContact CB-CE1 3.47Å; C456-H476 WeakPolarHBondContact CB-CE1 3.26Å; C456-H476 VanDerWaalsContact CB-ND1 3.3Å; C456-H476 WeakPolarHBondContact CB-ND1 2.97Å; C456-C479 WeakPolarHBondContact SG-CB 3.22Å
457	A	81.7	Confident	60.3	Low	9 Å²	9	69.2 Å²	69.2	7%	0.074	43%	0.428	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-10.5	-179.3	0	0	0	0	0	114.7	G455 R473 A474 Y475 V534	G455-A457 PolarHBondContact O-N 3.22Å; A457-R473 HydrophobicContact CB-CB 4.08Å; A457-R473 HydrophobicContact CB-CG 4.24Å; A457-A474 PolarHBondContact N-O 3.3Å; A457-Y475 HydrophobicContact CB-CD1 4.22Å; A457-Y475 HydrophobicContact CB-CE1 3.75Å; A457-V534 HydrophobicContact CB-CG1 4.11Å; A457-V534 WeakPolarHBondContact O-CA 3.37Å
458	I	82.9	Confident	62.7	Low	6 Å²	6	65.9 Å²	65.9	3%	0.031	39%	0.393	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.8	-53.9	-178.6	-68	165.3	0	0	0	111.1	C456 F460 Y475 C479 M530 L533 V534 T542	C456-I458 PolarHBondContact O-N 3Å; C456-I458 PolarHBondContact SG-N 2.96Å; I458-F460 WeakPolarHBondContact O-CE2 3.45Å; I458-Y475 HydrophobicContact CD1-CD1 3.75Å; I458-Y475 HydrophobicContact CD1-CE1 4.04Å; I458-Y475 HydrophobicContact CG1-CD1 4.12Å; I458-Y475 HydrophobicContact CG1-CE1 4.17Å; I458-C479 HydrophobicContact CB-CB 4.34Å; I458-C479 HydrophobicContact CD1-CB 4.27Å; I458-C479 WeakPolarHBondContact CD1-O 3.4Å; I458-M530 HydrophobicContact CD1-CE 3.84Å; I458-M530 HydrophobicContact CD1-SD 3.39Å; I458-M530 WeakPolarHBondContact CD1-SD 3.33Å; I458-M530 HydrophobicContact CG1-SD 4.47Å; I458-L533 HydrophobicContact CG1-CB 4.28Å; I458-L533 HydrophobicContact CG2-CB 4.1Å; I458-L533 HydrophobicContact CG2-CD1 4.21Å; I458-V534 HydrophobicContact CG1-CG1 4.04Å; I458-T542 HydrophobicContact CG2-CG2 4.38Å; I458-T542 WeakPolarHBondContact O-CB 3.16Å; I458-T542 WeakPolarHBondContact O-CG2 3.48Å; I458-T542 PolarHBondContact O-OG1 2.83Å
459	C	76.6	Confident	64.9	Low	37 Å²	37	60.3 Å²	60.3	25%	0.25	38%	0.383	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.6	0.4	-176.8	78.7	0	0	0	0	113.3	G461 H476	C459-G461 PolarHBondContact O-N 3.26Å; C459-G461 PolarHBondContact SG-N 3.47Å; C459-G461 VanDerWaalsContact SG-N 3.44Å; C459-H476 PolarHBondContact SG-CE1 3.34Å; C459-H476 PolarHBondContact SG-ND1 2.84Å; C459-H476 VanDerWaalsContact SG-ND1 3.37Å
460	F	71.6	Confident	67.2	Low	91 Å²	91	61.6 Å²	61.6	40%	0.399	37%	0.37	S	S	.	.			trans	56.2	11.9	-177.3	-53.6	-87.5	0	0	0	114.4	C456 I458 V539	C456-F460 WeakPolarHBondContact O-CA 3.4Å; C456-F460 PolarHBondContact O-N 2.89Å; I458-F460 WeakPolarHBondContact O-CE2 3.45Å; F460-V539 HydrophobicContact CD2-CB 4.05Å; F460-V539 HydrophobicContact CD2-CG2 3.78Å; F460-V539 HydrophobicContact CE2-CB 3.66Å; F460-V539 HydrophobicContact CE2-CG2 3.94Å; F460-V539 HydrophobicContact CG-CG2 4.36Å; F460-V539 HydrophobicContact CZ-CB 4.13Å
461	G	63.1	Low	69.6	Low	14 Å²	14	58.1 Å²	58.1	14%	0.144	35%	0.354	C	S	.	.			trans	-88.6	148.9	-178.7	0	0	0	0	0	111.8	G455 C456 C459 H476	G455-G461 WeakPolarHBondContact CA-O 3.45Å; C456-G461 WeakPolarHBondContact CB-O 3.29Å; C456-G461 PolarHBondContact N-O 2.65Å; C459-G461 PolarHBondContact O-N 3.26Å; C459-G461 PolarHBondContact SG-N 3.47Å; C459-G461 VanDerWaalsContact SG-N 3.44Å; G461-H476 PolarHBondContact O-CE1 3.21Å
462	V	66.3	Low	71.7	Confident	44 Å²	44	55.6 Å²	55.6	27%	0.267	34%	0.337	S	S	.	.			trans	-82.1	174.2	174.2	-51.1	0	0	0	0	110.7	E370 Y374 H476	E370-V462 WeakPolarHBondContact OE1-CG2 3.38Å; Y374-V462 WeakPolarHBondContact OH-CG2 3.27Å; V462-H476 PolarHBondContact O-NE2 2.69Å
463	G	67	Low	73.6	Confident	52 Å²	52	56.4 Å²	56.4	54%	0.536	33%	0.328	S	S	.	.	S	Bend	trans	137.7	-150.5	175.5	0	0	0	0	0	113.2	L465	G463-L465 PolarHBondContact O-N 3.4Å
464	L	71	Confident	75.2	Confident	147 Å²	147	52.5 Å²	52.5	77%	0.77	30%	0.304	S	S	*	.	S	Bend	trans	-78.7	105.9	177.3	-147.5	112.7	0	0	0	109.9
465	L	76.9	Confident	76.3	Confident	28 Å²	28	46.6 Å²	46.6	15%	0.147	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	136.4	-170.7	-57.3	172.1	0	0	0	112.9	C456 G463 H467 A474 Y475 H476	C456-L465 HydrophobicContact CB-CD2 3.74Å; G463-L465 PolarHBondContact O-N 3.4Å; L465-H467 PolarHBondContact O-CE1 3.05Å; L465-H467 PolarHBondContact O-ND1 2.85Å; L465-H467 VanDerWaalsContact O-ND1 3.12Å; L465-A474 HydrophobicContact CB-CB 3.87Å; L465-A474 HydrophobicContact CD1-CB 3.82Å; L465-A474 HydrophobicContact CG-CB 4.36Å; L465-Y475 CarbonylContact C-O 3.5Å; L465-Y475 WeakPolarHBondContact CA-O 3.4Å; L465-H476 HydrophobicContact CD2-CB 4.46Å; L465-H476 VanDerWaalsContact CD2-CD2 3.46Å; L465-H476 WeakPolarHBondContact CD2-CD2 3.41Å
466	A	74.3	Confident	76.6	Confident	7 Å²	7	47.7 Å²	47.7	6%	0.058	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	124.5	167	0	0	0	0	0	109.9	A474 Y475 I484 I487 W493	A466-A474 CarbonylContact O-C 3.59Å; A466-A474 VanDerWaalsContact O-CA 3.24Å; A466-A474 WeakPolarHBondContact O-CA 3.49Å; A466-Y475 PolarHBondContact N-O 3.38Å; A466-Y475 PolarHBondContact O-N 3.5Å; A466-I484 HydrophobicContact CB-CD1 3.97Å; A466-I487 HydrophobicContact CB-CD1 3.77Å; A466-W493 HydrophobicContact CB-CE3 4.39Å; A466-W493 HydrophobicContact CB-CH2 4.15Å; A466-W493 HydrophobicContact CB-CZ2 4.47Å; A466-W493 HydrophobicContact CB-CZ3 4.09Å
467	H	80.1	Confident	76.7	Confident	124 Å²	124	50.5 Å²	50.5	57%	0.574	29%	0.285	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102.3	125	-176.9	-63.5	77.1	0	0	0	110.9	L465 G469 W493	L465-H467 PolarHBondContact O-CE1 3.05Å; L465-H467 PolarHBondContact O-ND1 2.85Å; L465-H467 VanDerWaalsContact O-ND1 3.12Å; H467-G469 PolarHBondContact O-N 3.31Å; H467-W493 VanDerWaalsContact O-CE3 3.31Å
468	C	77	Confident	76.6	Confident	3 Å²	3	54.4 Å²	54.4	2%	0.02	31%	0.305	C	S	.	.	P	Polyproline II helix	trans	-72.7	122.5	176.8	179.9	0	0	0	0	110.7	R470 C471 S472 R473 W493 C495	C468-R470 PolarHBondContact O-N 3.34Å; C468-C471 VanDerWaalsContact CB-SG 3.58Å; C468-C471 PolarHBondContact SG-SG 2.9Å; C468-S472 WeakPolarHBondContact O-CA 3.29Å; C468-S472 PolarHBondContact O-N 3.22Å; C468-R473 WeakPolarHBondContact CB-O 3.36Å; C468-R473 PolarHBondContact N-O 3.05Å; C468-W493 HydrophobicContact CB-CE3 4.28Å; C468-W493 HydrophobicContact CB-CZ3 3.88Å; C468-C495 HydrophobicContact CB-CB 4.05Å; C468-C495 PolarHBondContact SG-N 3.47Å
469	G	74.8	Confident	76.7	Confident	60 Å²	60	54.9 Å²	54.9	62%	0.619	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.2	-11.2	178.2	0	0	0	0	0	115.3	H467 W493	H467-G469 PolarHBondContact O-N 3.31Å; G469-W493 PolarHBondContact N-O 3.06Å
470	R	77.8	Confident	77.1	Confident	144 Å²	144	53.1 Å²	53.1	54%	0.543	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.7	-45.3	179.8	-166.9	-178.6	-76.4	-171	-0.3	113.4	C468 V494 C498 D500	C468-R470 PolarHBondContact O-N 3.34Å; R470-V494 HydrophobicContact CB-CG1 4.04Å; R470-C498 HydrophobicContact CB-CB 4.06Å; R470-C498 HydrophobicContact CG-CB 4.49Å; R470-C498 PolarHBondContact NH1-O 3.42Å; R470-D500 IonicContact CZ-OD1 3.4Å; R470-D500 IonicContact CZ-OD2 3.47Å; R470-D500 IonicContact NH1-OD1 3.75Å; R470-D500 PolarHBondContact NH1-OD1 3.22Å; R470-D500 IonicContact NH1-OD2 2.69Å; R470-D500 PolarHBondContact NH1-OD2 3.41Å; R470-D500 IonicContact NH2-OD2 3.04Å; R470-D500 PolarHBondContact NH2-OD2 3.39Å
471	C	81.8	Confident	77.7	Confident	43 Å²	43	48.9 Å²	48.9	29%	0.291	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-109.8	-0.4	-177.4	69.5	0	0	0	0	114.4	C468 R473 C498	C468-C471 VanDerWaalsContact CB-SG 3.58Å; C468-C471 PolarHBondContact SG-SG 2.9Å; C471-R473 PolarHBondContact O-N 3.25Å; C471-C498 VanDerWaalsContact CB-SG 3.53Å; C471-C498 PolarHBondContact SG-SG 2.98Å
472	S	80.9	Confident	78.6	Confident	62 Å²	62	48.5 Å²	48.5	43%	0.434	27%	0.273	S	S	.	.			trans	60.1	3.5	-179.2	-52.6	0	0	0	0	115.9	C468	C468-S472 WeakPolarHBondContact O-CA 3.29Å; C468-S472 PolarHBondContact O-N 3.22Å
473	R	84.1	Confident	79.2	Confident	96 Å²	96	49.4 Å²	49.4	36%	0.362	27%	0.272	S	S	.	.			trans	-65.8	140.5	172.8	-70.2	-179	173.4	140.7	-1.8	110.8	A457 C468 C471 Y475	A457-R473 HydrophobicContact CB-CB 4.08Å; A457-R473 HydrophobicContact CB-CG 4.24Å; C468-R473 WeakPolarHBondContact CB-O 3.36Å; C468-R473 PolarHBondContact N-O 3.05Å; C471-R473 PolarHBondContact O-N 3.25Å; R473-Y475 HydrophobicContact CB-CE2 3.74Å; R473-Y475 WeakPolarHBondContact CD-OH 3.36Å
474	A	81.6	Confident	79.4	Confident	1 Å²	1	47.2 Å²	47.2	1%	0.008	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	144.8	179.6	0	0	0	0	0	110.9	C456 A457 L465 A466	C456-A474 CarbonylContact C-O 3.3Å; C456-A474 VanDerWaalsContact CA-O 3.27Å; C456-A474 WeakPolarHBondContact CA-O 3.14Å; A457-A474 PolarHBondContact N-O 3.3Å; L465-A474 HydrophobicContact CB-CB 3.87Å; L465-A474 HydrophobicContact CD1-CB 3.82Å; L465-A474 HydrophobicContact CG-CB 4.36Å; A466-A474 CarbonylContact O-C 3.59Å; A466-A474 VanDerWaalsContact O-CA 3.24Å; A466-A474 WeakPolarHBondContact O-CA 3.49Å
475	Y	82.1	Confident	79	Confident	0 Å²	0	47 Å²	47	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	140.2	-179.4	-55.6	-93.1	0	0	0	111.7	A457 I458 L465 A466 R473 H480 W493 C495 M530 V534	A457-Y475 HydrophobicContact CB-CD1 4.22Å; A457-Y475 HydrophobicContact CB-CE1 3.75Å; I458-Y475 HydrophobicContact CD1-CD1 3.75Å; I458-Y475 HydrophobicContact CD1-CE1 4.04Å; I458-Y475 HydrophobicContact CG1-CD1 4.12Å; I458-Y475 HydrophobicContact CG1-CE1 4.17Å; L465-Y475 CarbonylContact C-O 3.5Å; L465-Y475 WeakPolarHBondContact CA-O 3.4Å; A466-Y475 PolarHBondContact N-O 3.38Å; A466-Y475 PolarHBondContact O-N 3.5Å; R473-Y475 HydrophobicContact CB-CE2 3.74Å; R473-Y475 WeakPolarHBondContact CD-OH 3.36Å; Y475-H480 HydrophobicContact CG-CB 4.45Å; Y475-W493 AromaticContact CD2-CH2 3.89Å; Y475-W493 HydrophobicContact CD2-CH2 3.89Å; Y475-W493 HydrophobicContact CD2-CZ3 4.25Å; Y475-W493 HydrophobicContact CE2-CH2 4.37Å; Y475-C495 HydrophobicContact CD2-CB 4.3Å; Y475-C495 HydrophobicContact CE2-CB 3.56Å; Y475-M530 HydrophobicContact CD1-CE 3.91Å; Y475-M530 HydrophobicContact CE1-CE 3.48Å; Y475-M530 VanDerWaalsContact CE1-CE 3.48Å; Y475-V534 HydrophobicContact CE1-CG1 3.87Å
476	H	79.1	Confident	77.9	Confident	33 Å²	33	49 Å²	49	15%	0.153	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.2	151	162	-56.5	105.7	0	0	0	109.7	C456 C459 G461 V462 L465 D478 C479 H480	C456-H476 VanDerWaalsContact CB-CE1 3.47Å; C456-H476 WeakPolarHBondContact CB-CE1 3.26Å; C456-H476 VanDerWaalsContact CB-ND1 3.3Å; C456-H476 WeakPolarHBondContact CB-ND1 2.97Å; C459-H476 PolarHBondContact SG-CE1 3.34Å; C459-H476 PolarHBondContact SG-ND1 2.84Å; C459-H476 VanDerWaalsContact SG-ND1 3.37Å; G461-H476 PolarHBondContact O-CE1 3.21Å; V462-H476 PolarHBondContact O-NE2 2.69Å; L465-H476 HydrophobicContact CD2-CB 4.46Å; L465-H476 VanDerWaalsContact CD2-CD2 3.46Å; L465-H476 WeakPolarHBondContact CD2-CD2 3.41Å; H476-D478 PolarHBondContact O-N 2.99Å; H476-C479 HydrophobicContact CB-CB 3.83Å; H476-C479 PolarHBondContact ND1-SG 2.98Å; H476-C479 VanDerWaalsContact ND1-SG 3.4Å; H476-C479 PolarHBondContact O-N 2.78Å; H476-H480 PolarHBondContact O-N 3.13Å
477	L	79.8	Confident	76.9	Confident	59 Å²	59	51.3 Å²	51.3	31%	0.309	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.3	-43.6	174.8	-62.2	-178.7	0	0	0	112.2	I484 I487	L477-I484 HydrophobicContact CB-CB 4.46Å; L477-I484 HydrophobicContact CD2-CB 3.7Å; L477-I484 HydrophobicContact CD2-CD1 4.44Å; L477-I484 HydrophobicContact CD2-CG2 3.65Å; L477-I484 PolarHBondContact O-N 3.04Å; L477-I487 HydrophobicContact CD2-CD1 3.37Å; L477-I487 HydrophobicContact CD2-CG1 3.56Å
478	D	80.4	Confident	75.2	Confident	92 Å²	92	49.7 Å²	49.7	49%	0.492	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.1	-15.4	177.5	-75.3	-50.5	0	0	0	113.5	H476 R483 R576	H476-D478 PolarHBondContact O-N 2.99Å; D478-R483 IonicContact OD1-CZ 3.28Å; D478-R483 IonicContact OD1-NH1 3.93Å; D478-R483 PolarHBondContact OD1-NH1 3.46Å; D478-R576 PolarHBondContact O-NH2 3.02Å
479	C	83.5	Confident	73.6	Confident	15 Å²	15	57.3 Å²	57.3	10%	0.101	32%	0.317	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.9	-35.8	178.9	-75.8	0	0	0	0	111.8	C456 I458 H476	C456-C479 WeakPolarHBondContact SG-CB 3.22Å; I458-C479 HydrophobicContact CB-CB 4.34Å; I458-C479 HydrophobicContact CD1-CB 4.27Å; I458-C479 WeakPolarHBondContact CD1-O 3.4Å; H476-C479 HydrophobicContact CB-CB 3.83Å; H476-C479 PolarHBondContact ND1-SG 2.98Å; H476-C479 VanDerWaalsContact ND1-SG 3.4Å; H476-C479 PolarHBondContact O-N 2.78Å
480	H	85.6	Confident	72.4	Confident	1 Å²	1	58.2 Å²	58.2	1%	0.005	31%	0.31	C	S	.	.	S	Bend	trans	-63.7	146.1	178.6	-172.7	-86.8	0	0	0	112.1	Y475 H476 P482 R483 I484 W493 G496	Y475-H480 HydrophobicContact CG-CB 4.45Å; H476-H480 PolarHBondContact O-N 3.13Å; H480-P482 CarbonylContact C-O 3.1Å; H480-P482 PolarHBondContact ND1-O 3.16Å; H480-P482 CarbonylContact O-C 3.31Å; H480-P482 VanDerWaalsContact O-C 3.28Å; H480-R483 VanDerWaalsContact O-CA 3.31Å; H480-R483 WeakPolarHBondContact O-CA 2.95Å; H480-R483 PolarHBondContact O-N 3.41Å; H480-I484 HydrophobicContact CB-CD1 3.59Å; H480-I484 HydrophobicContact CB-CG1 3.82Å; H480-W493 AromaticContact CD2-CH2 3.83Å; H480-W493 AromaticContact CD2-CZ2 3.88Å; H480-W493 AromaticContact NE2-CH2 3.99Å; H480-W493 AromaticContact NE2-CZ2 3.75Å; H480-G496 PolarHBondContact NE2-N 3.4Å
481	L	84.4	Confident	71.2	Confident	1 Å²	1	57.7 Å²	57.7	1%	0.005	33%	0.326	C	S	.	.	S	Bend	trans	-120.4	125.8	172.4	-65.4	153.8	0	0	0	109.7	C526 L529 M530 L533 R576 E580	L481-C526 HydrophobicContact CB-CB 4.12Å; L481-L529 HydrophobicContact CD1-CB 4.08Å; L481-L529 HydrophobicContact CD1-CD2 3.61Å; L481-L529 HydrophobicContact CD1-CG 3.77Å; L481-M530 HydrophobicContact CB-CG 3.6Å; L481-M530 HydrophobicContact CB-SD 3.69Å; L481-M530 HydrophobicContact CD1-CG 3.93Å; L481-M530 HydrophobicContact CD1-SD 3.92Å; L481-M530 HydrophobicContact CG-CG 4.28Å; L481-M530 HydrophobicContact CG-SD 4.02Å; L481-M530 PolarHBondContact N-SD 3.18Å; L481-L533 HydrophobicContact CD1-CD1 4.47Å; L481-R576 HydrophobicContact CD2-CG 4.08Å; L481-E580 HydrophobicContact CD2-CG 3.93Å
482	P	81.4	Confident	70.3	Confident	6 Å²	6	60 Å²	60	4%	0.039	34%	0.342	C	S	.	.	S	Bend	cis	-57.4	154.1	-11.1	-25.9	37.5	0	0	0	113	H480 I484 V507 Y522 L523	H480-P482 CarbonylContact C-O 3.1Å; H480-P482 PolarHBondContact ND1-O 3.16Å; H480-P482 CarbonylContact O-C 3.31Å; H480-P482 VanDerWaalsContact O-C 3.28Å; P482-I484 PolarHBondContact O-N 3.17Å; P482-V507 HydrophobicContact CB-CG1 4.27Å; P482-Y522 HydrophobicContact CB-CE1 4.19Å; P482-Y522 VanDerWaalsContact CB-OH 3.31Å; P482-Y522 WeakPolarHBondContact CB-OH 3.42Å; P482-Y522 HydrophobicContact CG-CE1 3.62Å; P482-L523 HydrophobicContact CG-CD2 4.14Å
483	R	78.9	Confident	69.9	Low	64 Å²	64	58 Å²	58	24%	0.242	33%	0.325	C	S	.	.			trans	-54.9	140.8	175.6	-67.4	-168.3	-167.2	-159.3	8.5	110.8	D478 H480 N485 V507 E580	D478-R483 IonicContact OD1-CZ 3.28Å; D478-R483 IonicContact OD1-NH1 3.93Å; D478-R483 PolarHBondContact OD1-NH1 3.46Å; H480-R483 VanDerWaalsContact O-CA 3.31Å; H480-R483 WeakPolarHBondContact O-CA 2.95Å; H480-R483 PolarHBondContact O-N 3.41Å; R483-N485 PolarHBondContact O-N 2.82Å; R483-V507 WeakPolarHBondContact O-CG1 3.47Å; R483-E580 IonicContact CZ-OE2 3.8Å; R483-E580 VanDerWaalsContact CZ-OE2 3.28Å; R483-E580 IonicContact NE-OE1 2.63Å; R483-E580 IonicContact NE-OE2 3.49Å; R483-E580 PolarHBondContact NE-OE2 2.94Å; R483-E580 IonicContact NH2-OE2 3.78Å; R483-E580 PolarHBondContact NH2-OE2 2.8Å
484	I	71.8	Confident	69.6	Low	6 Å²	6	54.9 Å²	54.9	3%	0.031	32%	0.317	C	S	.	.			trans	-88.6	100.6	179.5	-56.4	163.7	0	0	0	107.9	A466 L477 H480 P482 I487 W493 V507	A466-I484 HydrophobicContact CB-CD1 3.97Å; L477-I484 HydrophobicContact CB-CB 4.46Å; L477-I484 HydrophobicContact CD2-CB 3.7Å; L477-I484 HydrophobicContact CD2-CD1 4.44Å; L477-I484 HydrophobicContact CD2-CG2 3.65Å; L477-I484 PolarHBondContact O-N 3.04Å; H480-I484 HydrophobicContact CB-CD1 3.59Å; H480-I484 HydrophobicContact CB-CG1 3.82Å; P482-I484 PolarHBondContact O-N 3.17Å; I484-I487 HydrophobicContact CG2-CG1 3.65Å; I484-W493 HydrophobicContact CD1-CH2 4.16Å; I484-W493 HydrophobicContact CD1-CZ2 3.59Å; I484-W493 HydrophobicContact CG1-CZ2 4.41Å; I484-V507 HydrophobicContact CG1-CG2 4.21Å
485	N	63.4	Low	69.7	Low	143 Å²	143	54.9 Å²	54.9	77%	0.765	32%	0.316	S	S	*	.	S	Bend	trans	-79.4	-21.7	-177.9	-66.5	-11.1	0	0	0	113.3	R483	R483-N485 PolarHBondContact O-N 2.82Å
486	S	53.9	Low	69.7	Low	69 Å²	69	55.3 Å²	55.3	48%	0.483	32%	0.321	S	S	.	.			trans	-154.8	121.6	176.7	59	0	0	0	0	110.1
487	I	51.6	Low	69.9	Low	55 Å²	55	56 Å²	56	28%	0.282	33%	0.326	S	S	.	.			trans	-89	106.6	164.8	-60.4	171	0	0	0	106.9	A466 L477 I484 L489	A466-I487 HydrophobicContact CB-CD1 3.77Å; L477-I487 HydrophobicContact CD2-CD1 3.37Å; L477-I487 HydrophobicContact CD2-CG1 3.56Å; I484-I487 HydrophobicContact CG2-CG1 3.65Å; I487-L489 HydrophobicContact CG2-CD2 4.03Å; I487-L489 HydrophobicContact CG2-CG 4.05Å; I487-L489 PolarHBondContact O-N 3.38Å
488	S	45.3	Very low	70	Confident	90 Å²	90	54.1 Å²	54.1	63%	0.629	32%	0.317	S	S	*	.			trans	-66.7	113.1	148.2	-74.7	0	0	0	0	105.3	T490	S488-T490 PolarHBondContact O-N 2.96Å; S488-T490 PolarHBondContact O-OG1 3.33Å
489	L	43.9	Very low	69.8	Low	164 Å²	164	50.5 Å²	50.5	86%	0.859	30%	0.3	S	S	*	.			trans	-67.5	48.7	-176.4	-76.2	156.8	0	0	0	112.3	I487	I487-L489 HydrophobicContact CG2-CD2 4.03Å; I487-L489 HydrophobicContact CG2-CG 4.05Å; I487-L489 PolarHBondContact O-N 3.38Å
490	T	49	Very low	68.8	Low	78 Å²	78	53.7 Å²	53.7	48%	0.479	32%	0.316	S	S	.	.			trans	-79.3	130.6	171.5	49.7	0	0	0	0	108.7	S488 S492 W493	S488-T490 PolarHBondContact O-N 2.96Å; S488-T490 PolarHBondContact O-OG1 3.33Å; T490-S492 PolarHBondContact O-N 3.15Å; T490-W493 PolarHBondContact O-N 3.03Å
491	P	53.5	Low	67.4	Low	134 Å²	134	60.1 Å²	60.1	87%	0.87	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.7	0.7	179.2	23.9	-32.3	0	0	0	114.1
492	S	62.4	Low	65.4	Low	91 Å²	91	69.1 Å²	69.1	64%	0.636	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.5	8.5	179.3	62.2	0	0	0	0	114.1	T490 V494	T490-S492 PolarHBondContact O-N 3.15Å; S492-V494 PolarHBondContact O-N 2.82Å
493	W	71.6	Confident	63.6	Low	21 Å²	21	72.7 Å²	72.7	8%	0.08	41%	0.414	C	S	.	.			trans	-62.5	131.3	178.4	-177.1	90	0	0	0	111.3	A466 H467 C468 G469 Y475 H480 I484 T490 C495 A506	A466-W493 HydrophobicContact CB-CE3 4.39Å; A466-W493 HydrophobicContact CB-CH2 4.15Å; A466-W493 HydrophobicContact CB-CZ2 4.47Å; A466-W493 HydrophobicContact CB-CZ3 4.09Å; H467-W493 VanDerWaalsContact O-CE3 3.31Å; C468-W493 HydrophobicContact CB-CE3 4.28Å; C468-W493 HydrophobicContact CB-CZ3 3.88Å; G469-W493 PolarHBondContact N-O 3.06Å; Y475-W493 AromaticContact CD2-CH2 3.89Å; Y475-W493 HydrophobicContact CD2-CH2 3.89Å; Y475-W493 HydrophobicContact CD2-CZ3 4.25Å; Y475-W493 HydrophobicContact CE2-CH2 4.37Å; H480-W493 AromaticContact CD2-CH2 3.83Å; H480-W493 AromaticContact CD2-CZ2 3.88Å; H480-W493 AromaticContact NE2-CH2 3.99Å; H480-W493 AromaticContact NE2-CZ2 3.75Å; I484-W493 HydrophobicContact CD1-CH2 4.16Å; I484-W493 HydrophobicContact CD1-CZ2 3.59Å; I484-W493 HydrophobicContact CG1-CZ2 4.41Å; T490-W493 PolarHBondContact O-N 3.03Å; W493-C495 HydrophobicContact CH2-CB 3.63Å; W493-C495 HydrophobicContact CZ2-CB 4.32Å; W493-C495 HydrophobicContact CZ3-CB 4.01Å; W493-A506 HydrophobicContact CG-CB 4.24Å
494	V	77.9	Confident	61.9	Low	30 Å²	30	77 Å²	77	18%	0.182	44%	0.436	C	S	.	.			trans	-122.7	139.9	173.7	-66.1	0	0	0	0	109.8	R470 S492 C498 A499	R470-V494 HydrophobicContact CB-CG1 4.04Å; S492-V494 PolarHBondContact O-N 2.82Å; V494-C498 HydrophobicContact CB-CB 4.19Å; V494-A499 HydrophobicContact CG2-CB 4.11Å
495	C	84.3	Confident	60.7	Low	0 Å²	0	77.7 Å²	77.7	0%	0	44%	0.442	C	S	.	.			trans	-70.4	162.8	179.2	73.5	0	0	0	0	111.9	C468 Y475 W493 L497 C498 A499	C468-C495 HydrophobicContact CB-CB 4.05Å; C468-C495 PolarHBondContact SG-N 3.47Å; Y475-C495 HydrophobicContact CD2-CB 4.3Å; Y475-C495 HydrophobicContact CE2-CB 3.56Å; W493-C495 HydrophobicContact CH2-CB 3.63Å; W493-C495 HydrophobicContact CZ2-CB 4.32Å; W493-C495 HydrophobicContact CZ3-CB 4.01Å; C495-L497 PolarHBondContact O-N 3.18Å; C495-C498 CarbonylContact O-C 3.28Å; C495-C498 WeakPolarHBondContact O-CA 3.37Å; C495-C498 PolarHBondContact O-N 3.26Å; C495-A499 PolarHBondContact O-N 2.97Å
496	G	81.6	Confident	59.8	Low	9 Å²	9	73 Å²	73	9%	0.093	42%	0.423	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.1	-19.6	-178.5	0	0	0	0	0	116	H480	H480-G496 PolarHBondContact NE2-N 3.4Å
497	L	83.8	Confident	59.6	Low	49 Å²	49	70.3 Å²	70.3	26%	0.257	40%	0.404	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.3	-18.3	173	-63.3	174.6	0	0	0	113.3	C495 R527 M530 V534	C495-L497 PolarHBondContact O-N 3.18Å; L497-R527 HydrophobicContact CD2-CB 4.47Å; L497-M530 HydrophobicContact CD1-CB 4.41Å; L497-M530 HydrophobicContact CD2-CB 4.14Å; L497-M530 HydrophobicContact CG-CB 4.26Å; L497-V534 HydrophobicContact CD1-CG1 4.27Å; L497-V534 HydrophobicContact CD1-CG2 3.78Å
498	C	81	Confident	59.1	Low	18 Å²	18	75.7 Å²	75.7	12%	0.122	43%	0.427	C	S	.	.	T	Hydrogen-bonded Turn	trans	-109.4	-17.2	-178.8	-69.6	0	0	0	0	113.5	R470 C471 V494 C495 D500	R470-C498 HydrophobicContact CB-CB 4.06Å; R470-C498 HydrophobicContact CG-CB 4.49Å; R470-C498 PolarHBondContact NH1-O 3.42Å; C471-C498 VanDerWaalsContact CB-SG 3.53Å; C471-C498 PolarHBondContact SG-SG 2.98Å; V494-C498 HydrophobicContact CB-CB 4.19Å; C495-C498 CarbonylContact O-C 3.28Å; C495-C498 WeakPolarHBondContact O-CA 3.37Å; C495-C498 PolarHBondContact O-N 3.26Å; C498-D500 PolarHBondContact O-N 3.23Å
499	A	76.2	Confident	59.2	Low	17 Å²	17	72.9 Å²	72.9	14%	0.14	41%	0.406	C	S	.	.	S	Bend	trans	-65.8	118.1	172.5	0	0	0	0	0	108.5	V494 C495	V494-A499 HydrophobicContact CG2-CB 4.11Å; C495-A499 PolarHBondContact O-N 2.97Å
500	D	63.2	Low	59.2	Low	82 Å²	82	71.6 Å²	71.6	44%	0.439	40%	0.396	S	S	.	.			trans	-63.9	146.7	170.4	-54.6	-48.3	0	0	0	108	R470 C498 E502 V503	R470-D500 IonicContact CZ-OD1 3.4Å; R470-D500 IonicContact CZ-OD2 3.47Å; R470-D500 IonicContact NH1-OD1 3.75Å; R470-D500 PolarHBondContact NH1-OD1 3.22Å; R470-D500 IonicContact NH1-OD2 2.69Å; R470-D500 PolarHBondContact NH1-OD2 3.41Å; R470-D500 IonicContact NH2-OD2 3.04Å; R470-D500 PolarHBondContact NH2-OD2 3.39Å; C498-D500 PolarHBondContact O-N 3.23Å; D500-E502 PolarHBondContact O-N 2.97Å; D500-V503 HydrophobicContact CB-CG2 4.36Å; D500-V503 PolarHBondContact O-N 3.42Å
501	D	56.1	Low	59.1	Low	136 Å²	136	76.4 Å²	76.4	73%	0.727	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.4	-17.3	-172.6	-82	-43.8	0	0	0	114.6	R527	D501-R527 IonicContact OD1-CZ 3.81Å; D501-R527 IonicContact OD1-NH1 3.22Å; D501-R527 PolarHBondContact OD1-NH1 3.36Å; D501-R527 IonicContact OD1-NH2 3.5Å; D501-R527 PolarHBondContact OD1-NH2 3.17Å
502	E	42.9	Very low	58.5	Low	190 Å²	190	74.4 Å²	74.4	89%	0.888	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95	-16	-179.1	-62.7	-177.7	167.8	0	0	114.5	D500 E504	D500-E502 PolarHBondContact O-N 2.97Å; E502-E504 PolarHBondContact O-N 3.38Å
503	V	42.8	Very low	57.7	Low	81 Å²	81	72.4 Å²	72.4	49%	0.491	39%	0.386	S	S	.	.	S	Bend	trans	-88.9	109.8	179.9	-175.2	0	0	0	0	107.3	D500 S505	D500-V503 HydrophobicContact CB-CG2 4.36Å; D500-V503 PolarHBondContact O-N 3.42Å; V503-S505 PolarHBondContact O-N 3.11Å
504	E	43.7	Very low	56.5	Low	153 Å²	153	78.2 Å²	78.2	72%	0.715	42%	0.419	S	S	*	.			trans	-36.4	108.1	168.6	-84.9	-179.6	138.1	0	0	109.2	E502 A506	E502-E504 PolarHBondContact O-N 3.38Å; E504-A506 PolarHBondContact O-N 2.9Å
505	S	46.1	Very low	55.6	Low	21 Å²	21	77.7 Å²	77.7	15%	0.147	42%	0.42	C	S	.	.			trans	-49	134.8	179.1	-157.6	0	0	0	0	107.6	V503 V507	V503-S505 PolarHBondContact O-N 3.11Å; S505-V507 CarbonylContact O-C 2.89Å; S505-V507 VanDerWaalsContact O-C 3.31Å; S505-V507 PolarHBondContact O-N 3.03Å
506	A	45.9	Very low	54.9	Low	45 Å²	45	82.2 Å²	82.2	37%	0.372	44%	0.436	S	S	.	.	S	Bend	trans	-62.6	2.4	-177.4	0	0	0	0	0	114.3	W493 E504	W493-A506 HydrophobicContact CG-CB 4.24Å; E504-A506 PolarHBondContact O-N 2.9Å
507	V	48.1	Very low	54.6	Low	12 Å²	12	82.5 Å²	82.5	7%	0.073	44%	0.435	C	S	.	.	S	Bend	trans	-95.7	112.3	163	-169	0	0	0	0	107.5	P482 R483 I484 S505 V509	P482-V507 HydrophobicContact CB-CG1 4.27Å; R483-V507 WeakPolarHBondContact O-CG1 3.47Å; I484-V507 HydrophobicContact CG1-CG2 4.21Å; S505-V507 CarbonylContact O-C 2.89Å; S505-V507 VanDerWaalsContact O-C 3.31Å; S505-V507 PolarHBondContact O-N 3.03Å; V507-V509 HydrophobicContact CG1-CG2 4.43Å; V507-V509 PolarHBondContact O-N 3.49Å
508	H	42.6	Very low	54.4	Low	168 Å²	168	83 Å²	83	78%	0.778	44%	0.443	S	S	*	.			trans	-59	84.6	168.4	-75.1	-72.9	0	0	0	109.7	E510	H508-E510 PolarHBondContact O-N 3.44Å
509	V	47.7	Very low	54.2	Low	31 Å²	31	87.2 Å²	87.2	19%	0.188	46%	0.456	C	S	.	.			trans	-81	102.5	160	-179.3	0	0	0	0	104.3	V507 E511 R519	V507-V509 HydrophobicContact CG1-CG2 4.43Å; V507-V509 PolarHBondContact O-N 3.49Å; V509-E511 PolarHBondContact O-N 2.93Å; V509-R519 VanDerWaalsContact CB-NH1 3.33Å; V509-R519 VanDerWaalsContact CG1-NH1 3.34Å; V509-R519 PolarHBondContact O-NH1 3.26Å
510	E	43.2	Very low	54.5	Low	137 Å²	137	89.3 Å²	89.3	64%	0.64	47%	0.47	S	S	*	.			trans	-48.1	134.9	178.9	-68.4	-176.7	163.7	0	0	110.5	H508 S512 V513	H508-E510 PolarHBondContact O-N 3.44Å; E510-S512 PolarHBondContact O-N 2.91Å; E510-S512 VanDerWaalsContact O-N 3.11Å; E510-V513 HydrophobicContact CB-CG2 4.07Å; E510-V513 WeakPolarHBondContact O-CG2 3.2Å; E510-V513 PolarHBondContact O-N 3.35Å
511	E	47.6	Very low	55.6	Low	180 Å²	180	86.9 Å²	86.9	84%	0.841	46%	0.457	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.3	-19	-178.9	-70.2	-178.5	140.6	0	0	113.2	V509	V509-E511 PolarHBondContact O-N 2.93Å
512	S	40.7	Very low	57	Low	92 Å²	92	81.2 Å²	81.2	64%	0.643	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.1	5	-172.8	55.1	0	0	0	0	115	E510 N514	E510-S512 PolarHBondContact O-N 2.91Å; E510-S512 VanDerWaalsContact O-N 3.11Å; S512-N514 PolarHBondContact O-N 2.92Å
513	V	44.8	Very low	59.1	Low	48 Å²	48	73.7 Å²	73.7	29%	0.291	39%	0.391	S	S	.	.			trans	-84.9	97.5	-174.9	-171.6	0	0	0	0	111	E510 G515 A583 T585	E510-V513 HydrophobicContact CB-CG2 4.07Å; E510-V513 WeakPolarHBondContact O-CG2 3.2Å; E510-V513 PolarHBondContact O-N 3.35Å; V513-G515 PolarHBondContact O-N 2.94Å; V513-A583 WeakPolarHBondContact CG1-O 3.49Å; V513-T585 HydrophobicContact CG1-CG2 3.94Å
514	N	47.1	Very low	61.2	Low	144 Å²	144	69.9 Å²	69.9	77%	0.77	37%	0.368	S	S	*	.			trans	-68.9	66.8	160.3	-78.3	-16.6	0	0	0	109.5	S512	S512-N514 PolarHBondContact O-N 2.92Å
515	G	58	Low	63.4	Low	19 Å²	19	62.6 Å²	62.6	20%	0.196	33%	0.334	C	S	.	.			trans	-66.8	169.4	170.6	0	0	0	0	0	111.4	V513 F517 A582	V513-G515 PolarHBondContact O-N 2.94Å; G515-F517 VanDerWaalsContact C-N 3.26Å; G515-F517 PolarHBondContact O-N 2.93Å; G515-A582 CarbonylContact C-O 3.49Å; G515-A582 WeakPolarHBondContact CA-O 3.24Å
516	R	69.4	Low	65.4	Low	94 Å²	94	61.7 Å²	61.7	36%	0.355	33%	0.328	S	S	.	.	S	Bend	trans	-66.8	-30.1	-179.6	-62.3	-176	-175.3	151.5	9.5	112.1	E581 A582	R516-E581 IonicContact CZ-OE1 3.47Å; R516-E581 IonicContact NH1-OE1 2.81Å; R516-E581 PolarHBondContact NH1-OE1 3.47Å; R516-E581 IonicContact NH1-OE2 3Å; R516-E581 IonicContact NH2-OE1 3.59Å; R516-E581 PolarHBondContact NH2-OE1 3.26Å; R516-A582 PolarHBondContact N-O 2.88Å
517	F	76.1	Confident	67.5	Low	16 Å²	16	61.3 Å²	61.3	7%	0.07	32%	0.317	C	S	.	.	S	Bend	trans	-99.3	150.7	169.2	-73.5	2.5	0	0	0	110	G515 D521 L579 A582 C607 L608 W611	G515-F517 VanDerWaalsContact C-N 3.26Å; G515-F517 PolarHBondContact O-N 2.93Å; F517-D521 HydrophobicContact CB-CB 4.14Å; F517-L579 HydrophobicContact CD2-CD1 4.31Å; F517-L579 HydrophobicContact CE2-CD1 4.13Å; F517-A582 HydrophobicContact CB-CB 4.3Å; F517-A582 HydrophobicContact CD1-CB 4.26Å; F517-A582 HydrophobicContact CD2-CB 3.97Å; F517-A582 HydrophobicContact CE2-CB 4.35Å; F517-A582 HydrophobicContact CG-CB 3.92Å; F517-C607 WeakPolarHBondContact CZ-O 3.47Å; F517-L608 HydrophobicContact CE2-CB 4.37Å; F517-L608 HydrophobicContact CE2-CD1 4.23Å; F517-W611 HydrophobicContact CE2-CB 4.45Å; F517-W611 HydrophobicContact CZ-CB 4.07Å
518	S	78.8	Confident	69.6	Low	59 Å²	59	60.8 Å²	60.8	41%	0.413	31%	0.313	S	S	.	.			trans	-59.9	152	165.5	78.2	0	0	0	0	109.5	S520 D521 Y522	S518-S520 PolarHBondContact O-N 3.39Å; S518-D521 PolarHBondContact O-N 2.86Å; S518-D521 WeakPolarHBondContact OG-CB 3.35Å; S518-D521 PolarHBondContact OG-N 3.47Å; S518-D521 VanDerWaalsContact OG-N 3.14Å; S518-D521 PolarHBondContact OG-OD2 2.97Å; S518-Y522 PolarHBondContact O-N 2.85Å
519	R	77.8	Confident	71.9	Confident	106 Å²	106	52.9 Å²	52.9	40%	0.4	28%	0.277	S	S	.	.	H	α-helix	trans	-51.8	-42.7	176.9	-178.2	-174.3	179.2	90.3	-2.8	111.8	V509 L523	V509-R519 VanDerWaalsContact CB-NH1 3.33Å; V509-R519 VanDerWaalsContact CG1-NH1 3.34Å; V509-R519 PolarHBondContact O-NH1 3.26Å; R519-L523 HydrophobicContact CG-CD1 4.06Å; R519-L523 WeakPolarHBondContact O-CB 3.46Å; R519-L523 VanDerWaalsContact O-CG 3.29Å; R519-L523 WeakPolarHBondContact O-CG 3.29Å; R519-L523 PolarHBondContact O-N 3.47Å
520	S	82.3	Confident	73.9	Confident	62 Å²	62	51.5 Å²	51.5	43%	0.434	27%	0.268	S	S	.	.	H	α-helix	trans	-61	-45.3	177.4	179.3	0	0	0	0	111.6	S518 L523 A524 R654	S518-S520 PolarHBondContact O-N 3.39Å; S520-L523 PolarHBondContact O-N 2.82Å; S520-A524 VanDerWaalsContact O-CB 3.29Å; S520-A524 WeakPolarHBondContact O-CB 3.15Å; S520-A524 PolarHBondContact O-N 2.74Å; S520-R654 PolarHBondContact OG-NH1 3.25Å
521	D	85.3	Confident	76.1	Confident	30 Å²	30	45.2 Å²	45.2	16%	0.16	24%	0.24	C	C	.	.	H	α-helix	trans	-69.4	-40.5	-179.1	-66.6	-29.3	0	0	0	112.4	F517 S518 A524 G525 L608 R654	F517-D521 HydrophobicContact CB-CB 4.14Å; S518-D521 PolarHBondContact O-N 2.86Å; S518-D521 WeakPolarHBondContact OG-CB 3.35Å; S518-D521 PolarHBondContact OG-N 3.47Å; S518-D521 VanDerWaalsContact OG-N 3.14Å; S518-D521 PolarHBondContact OG-OD2 2.97Å; D521-A524 PolarHBondContact O-N 3.02Å; D521-G525 PolarHBondContact O-N 3.22Å; D521-L608 HydrophobicContact CB-CB 4.01Å; D521-L608 HydrophobicContact CB-CD2 4.17Å; D521-R654 IonicContact OD1-CZ 3.1Å; D521-R654 IonicContact OD1-NE 2.65Å; D521-R654 IonicContact OD1-NH1 3.26Å; D521-R654 PolarHBondContact OD1-NH1 2.68Å; D521-R654 IonicContact OD1-NH2 2.89Å; D521-R654 PolarHBondContact OD1-NH2 3.27Å
522	Y	85.3	Confident	78.2	Confident	18 Å²	18	36.6 Å²	36.6	7%	0.071	20%	0.2	C	C	.	.	H	α-helix	trans	-61.3	-47.5	174.7	170.6	-113.5	0	0	0	111.7	P482 S518 G525 C526 L579 A583	P482-Y522 HydrophobicContact CB-CE1 4.19Å; P482-Y522 VanDerWaalsContact CB-OH 3.31Å; P482-Y522 WeakPolarHBondContact CB-OH 3.42Å; P482-Y522 HydrophobicContact CG-CE1 3.62Å; S518-Y522 PolarHBondContact O-N 2.85Å; Y522-G525 PolarHBondContact O-N 2.92Å; Y522-C526 WeakPolarHBondContact CE2-SG 3.48Å; Y522-C526 VanDerWaalsContact CZ-SG 3.53Å; Y522-C526 PolarHBondContact O-N 3.05Å; Y522-C526 PolarHBondContact O-SG 2.7Å; Y522-L579 HydrophobicContact CD2-CD1 4.05Å; Y522-L579 HydrophobicContact CD2-CG 4.35Å; Y522-L579 WeakPolarHBondContact CD2-O 3.49Å; Y522-L579 HydrophobicContact CE2-CD1 4.47Å; Y522-L579 HydrophobicContact CE2-CG 4.27Å; Y522-L579 WeakPolarHBondContact CE2-O 2.99Å; Y522-A583 HydrophobicContact CD1-CB 4.2Å; Y522-A583 HydrophobicContact CD2-CB 4.04Å; Y522-A583 HydrophobicContact CE1-CB 3.81Å; Y522-A583 HydrophobicContact CE2-CB 3.66Å; Y522-A583 HydrophobicContact CG-CB 4.29Å
523	L	86.8	Confident	80.4	Confident	31 Å²	31	32.6 Å²	32.6	16%	0.162	17%	0.171	C	C	.	.	H	α-helix	trans	-66	-39.3	177.9	-69.3	176.1	0	0	0	111.8	P482 R519 S520 C526 R527	P482-L523 HydrophobicContact CG-CD2 4.14Å; R519-L523 HydrophobicContact CG-CD1 4.06Å; R519-L523 WeakPolarHBondContact O-CB 3.46Å; R519-L523 VanDerWaalsContact O-CG 3.29Å; R519-L523 WeakPolarHBondContact O-CG 3.29Å; R519-L523 PolarHBondContact O-N 3.47Å; S520-L523 PolarHBondContact O-N 2.82Å; L523-C526 PolarHBondContact O-N 3.11Å; L523-R527 WeakPolarHBondContact O-CG 3.47Å; L523-R527 PolarHBondContact O-N 3.36Å
524	A	87.6	Confident	82.4	Confident	1 Å²	1	31.1 Å²	31.1	1%	0.008	16%	0.162	C	C	.	.	H	α-helix	trans	-61.1	-46.3	173.4	0	0	0	0	0	111.5	S520 D521 C526 R527 I528 L608	S520-A524 VanDerWaalsContact O-CB 3.29Å; S520-A524 WeakPolarHBondContact O-CB 3.15Å; S520-A524 PolarHBondContact O-N 2.74Å; D521-A524 PolarHBondContact O-N 3.02Å; A524-C526 VanDerWaalsContact C-N 3.33Å; A524-C526 PolarHBondContact O-N 3.04Å; A524-R527 PolarHBondContact O-N 3.19Å; A524-I528 VanDerWaalsContact O-CG1 3.27Å; A524-I528 WeakPolarHBondContact O-CG1 3.3Å; A524-I528 PolarHBondContact O-N 3.09Å; A524-L608 HydrophobicContact CB-CD2 3.96Å
525	G	89.4	Confident	84.1	Confident	0 Å²	0	26.9 Å²	26.9	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-58.9	-42.7	174	0	0	0	0	0	112.5	D521 Y522 I528 L529	D521-G525 PolarHBondContact O-N 3.22Å; Y522-G525 PolarHBondContact O-N 2.92Å; G525-I528 PolarHBondContact O-N 2.94Å; G525-L529 WeakPolarHBondContact O-CB 2.93Å; G525-L529 PolarHBondContact O-N 3.33Å
526	C	89.8	Confident	84.7	Confident	2 Å²	2	33.8 Å²	33.8	1%	0.014	17%	0.165	C	C	.	.	H	α-helix	trans	-61.4	-47	175.9	-70.6	0	0	0	0	111.4	L481 Y522 L523 A524 L529 M530	L481-C526 HydrophobicContact CB-CB 4.12Å; Y522-C526 WeakPolarHBondContact CE2-SG 3.48Å; Y522-C526 VanDerWaalsContact CZ-SG 3.53Å; Y522-C526 PolarHBondContact O-N 3.05Å; Y522-C526 PolarHBondContact O-SG 2.7Å; L523-C526 PolarHBondContact O-N 3.11Å; A524-C526 VanDerWaalsContact C-N 3.33Å; A524-C526 PolarHBondContact O-N 3.04Å; C526-L529 PolarHBondContact O-N 2.83Å; C526-M530 WeakPolarHBondContact O-CB 3.41Å; C526-M530 WeakPolarHBondContact O-CG 3.5Å; C526-M530 PolarHBondContact O-N 3.39Å
527	R	89.8	Confident	85	Confident	38 Å²	38	31.1 Å²	31.1	14%	0.143	16%	0.156	C	C	.	.	H	α-helix	trans	-63.3	-42	178.4	-73	-173.4	-75.1	-123.7	13.3	112.5	L497 D501 L523 A524 G531 H653	L497-R527 HydrophobicContact CD2-CB 4.47Å; D501-R527 IonicContact OD1-CZ 3.81Å; D501-R527 IonicContact OD1-NH1 3.22Å; D501-R527 PolarHBondContact OD1-NH1 3.36Å; D501-R527 IonicContact OD1-NH2 3.5Å; D501-R527 PolarHBondContact OD1-NH2 3.17Å; L523-R527 WeakPolarHBondContact O-CG 3.47Å; L523-R527 PolarHBondContact O-N 3.36Å; A524-R527 PolarHBondContact O-N 3.19Å; R527-G531 PolarHBondContact O-N 2.94Å; R527-H653 VanDerWaalsContact CB-CD2 3.42Å; R527-H653 WeakPolarHBondContact CB-CD2 3.48Å
528	I	91.3	Very high	85.1	Confident	0 Å²	0	30.4 Å²	30.4	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-64.6	-48.9	178.1	-68.4	166.6	0	0	0	110.6	A524 G525 G531 L532 L612 L646 L649 V650 H653	A524-I528 VanDerWaalsContact O-CG1 3.27Å; A524-I528 WeakPolarHBondContact O-CG1 3.3Å; A524-I528 PolarHBondContact O-N 3.09Å; G525-I528 PolarHBondContact O-N 2.94Å; I528-G531 PolarHBondContact O-N 3.4Å; I528-L532 HydrophobicContact CG2-CD1 4.46Å; I528-L532 WeakPolarHBondContact O-CG 3.48Å; I528-L532 PolarHBondContact O-N 3.45Å; I528-L532 VanDerWaalsContact O-N 3.08Å; I528-L612 HydrophobicContact CD1-CD2 3.99Å; I528-L612 HydrophobicContact CG2-CD2 4.16Å; I528-L646 HydrophobicContact CG2-CD1 3.59Å; I528-L649 HydrophobicContact CG1-CB 4.4Å; I528-L649 HydrophobicContact CG2-CB 4.48Å; I528-V650 HydrophobicContact CD1-CG2 4.02Å; I528-V650 HydrophobicContact CG2-CG2 4.49Å; I528-H653 HydrophobicContact CG1-CB 4.29Å
529	L	91.5	Very high	84.7	Confident	2 Å²	2	31 Å²	31	1%	0.01	15%	0.154	C	C	.	.	H	α-helix	trans	-64.6	-43.8	178.8	-174.3	56.3	0	0	0	111.3	L481 G525 C526 G531 L532 L533 L572 R576 L579 W611	L481-L529 HydrophobicContact CD1-CB 4.08Å; L481-L529 HydrophobicContact CD1-CD2 3.61Å; L481-L529 HydrophobicContact CD1-CG 3.77Å; G525-L529 WeakPolarHBondContact O-CB 2.93Å; G525-L529 PolarHBondContact O-N 3.33Å; C526-L529 PolarHBondContact O-N 2.83Å; L529-G531 PolarHBondContact O-N 3.07Å; L529-L532 PolarHBondContact O-N 3.42Å; L529-L533 HydrophobicContact CD1-CD1 4.02Å; L529-L533 HydrophobicContact CD1-CG 4.07Å; L529-L533 HydrophobicContact CG-CD1 3.88Å; L529-L533 HydrophobicContact CG-CG 4.31Å; L529-L533 WeakPolarHBondContact O-CB 3.36Å; L529-L533 VanDerWaalsContact O-CG 3.26Å; L529-L533 WeakPolarHBondContact O-CG 3.25Å; L529-L533 PolarHBondContact O-N 3.38Å; L529-L572 HydrophobicContact CD1-CD1 4.42Å; L529-R576 HydrophobicContact CD2-CB 3.85Å; L529-R576 HydrophobicContact CD2-CG 3.94Å; L529-L579 HydrophobicContact CB-CD2 4.3Å; L529-L579 HydrophobicContact CD2-CD2 4.09Å; L529-W611 HydrophobicContact CB-CH2 3.99Å; L529-W611 HydrophobicContact CB-CZ2 4.28Å; L529-W611 HydrophobicContact CD2-CZ2 4.25Å
530	M	90	Very high	84.3	Confident	3 Å²	3	29.1 Å²	29.1	2%	0.015	15%	0.15	C	C	.	.	H	α-helix	trans	-58.7	-48.5	175.2	-74.6	-75.6	-70.9	0	0	111.4	I458 Y475 L481 L497 C526 L532 L533 V534	I458-M530 HydrophobicContact CD1-CE 3.84Å; I458-M530 HydrophobicContact CD1-SD 3.39Å; I458-M530 WeakPolarHBondContact CD1-SD 3.33Å; I458-M530 HydrophobicContact CG1-SD 4.47Å; Y475-M530 HydrophobicContact CD1-CE 3.91Å; Y475-M530 HydrophobicContact CE1-CE 3.48Å; Y475-M530 VanDerWaalsContact CE1-CE 3.48Å; L481-M530 HydrophobicContact CB-CG 3.6Å; L481-M530 HydrophobicContact CB-SD 3.69Å; L481-M530 HydrophobicContact CD1-CG 3.93Å; L481-M530 HydrophobicContact CD1-SD 3.92Å; L481-M530 HydrophobicContact CG-CG 4.28Å; L481-M530 HydrophobicContact CG-SD 4.02Å; L481-M530 PolarHBondContact N-SD 3.18Å; L497-M530 HydrophobicContact CD1-CB 4.41Å; L497-M530 HydrophobicContact CD2-CB 4.14Å; L497-M530 HydrophobicContact CG-CB 4.26Å; C526-M530 WeakPolarHBondContact O-CB 3.41Å; C526-M530 WeakPolarHBondContact O-CG 3.5Å; C526-M530 PolarHBondContact O-N 3.39Å; M530-L532 PolarHBondContact O-N 3.15Å; M530-L533 PolarHBondContact O-N 3.37Å; M530-L533 VanDerWaalsContact O-N 3.09Å; M530-V534 WeakPolarHBondContact O-CG1 3.47Å; M530-V534 WeakPolarHBondContact O-CG2 3.41Å; M530-V534 PolarHBondContact O-N 2.97Å
531	G	88.7	Confident	84.1	Confident	4 Å²	4	26.9 Å²	26.9	4%	0.041	13%	0.132	C	C	.	.	H	α-helix	trans	-57.1	-38.9	179.3	0	0	0	0	0	112.3	R527 I528 L529 V534	R527-G531 PolarHBondContact O-N 2.94Å; I528-G531 PolarHBondContact O-N 3.4Å; L529-G531 PolarHBondContact O-N 3.07Å; G531-V534 WeakPolarHBondContact O-CG2 3.34Å
532	L	91.4	Very high	83.5	Confident	0 Å²	0	26.7 Å²	26.7	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-67.7	-46.8	173	-71.6	170.2	0	0	0	112.7	I528 L529 M530 V534 H535 A538 V615 L642 H645 L646 L649	I528-L532 HydrophobicContact CG2-CD1 4.46Å; I528-L532 WeakPolarHBondContact O-CG 3.48Å; I528-L532 PolarHBondContact O-N 3.45Å; I528-L532 VanDerWaalsContact O-N 3.08Å; L529-L532 PolarHBondContact O-N 3.42Å; M530-L532 PolarHBondContact O-N 3.15Å; L532-V534 PolarHBondContact O-N 2.93Å; L532-H535 VanDerWaalsContact O-CB 3.3Å; L532-H535 WeakPolarHBondContact O-CB 3.45Å; L532-H535 PolarHBondContact O-N 3.31Å; L532-A538 VanDerWaalsContact O-CB 3.3Å; L532-A538 WeakPolarHBondContact O-CB 3.14Å; L532-V615 HydrophobicContact CD1-CG1 4.14Å; L532-L642 HydrophobicContact CD2-CB 4.48Å; L532-L642 HydrophobicContact CD2-CD2 4.5Å; L532-L642 VanDerWaalsContact CD2-O 3.27Å; L532-L642 WeakPolarHBondContact CD2-O 3.17Å; L532-H645 HydrophobicContact CD2-CB 4.46Å; L532-L646 HydrophobicContact CD1-CB 4.41Å; L532-L646 HydrophobicContact CD1-CD1 4Å; L532-L646 HydrophobicContact CD2-CB 4.01Å; L532-L649 HydrophobicContact CD2-CD1 4.03Å; L532-L649 HydrophobicContact CG-CD1 3.8Å
533	L	88.2	Confident	82.8	Confident	8 Å²	8	27.4 Å²	27.4	4%	0.042	14%	0.142	C	C	.	.	H	α-helix	trans	-74.6	-22.6	-173.2	-66	178.8	0	0	0	113.8	I458 L481 L529 M530 H535 T542 L572	I458-L533 HydrophobicContact CG1-CB 4.28Å; I458-L533 HydrophobicContact CG2-CB 4.1Å; I458-L533 HydrophobicContact CG2-CD1 4.21Å; L481-L533 HydrophobicContact CD1-CD1 4.47Å; L529-L533 HydrophobicContact CD1-CD1 4.02Å; L529-L533 HydrophobicContact CD1-CG 4.07Å; L529-L533 HydrophobicContact CG-CD1 3.88Å; L529-L533 HydrophobicContact CG-CG 4.31Å; L529-L533 WeakPolarHBondContact O-CB 3.36Å; L529-L533 VanDerWaalsContact O-CG 3.26Å; L529-L533 WeakPolarHBondContact O-CG 3.25Å; L529-L533 PolarHBondContact O-N 3.38Å; M530-L533 PolarHBondContact O-N 3.37Å; M530-L533 VanDerWaalsContact O-N 3.09Å; L533-H535 VanDerWaalsContact C-N 3.32Å; L533-T542 HydrophobicContact CB-CG2 4.5Å; L533-T542 HydrophobicContact CD2-CG2 3.82Å; L533-L572 HydrophobicContact CD2-CD2 4.11Å
534	V	85.5	Confident	82	Confident	16 Å²	16	30 Å²	30	10%	0.097	16%	0.163	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.4	-8.3	174.1	-60.4	0	0	0	0	113.7	A457 I458 Y475 L497 M530 G531 L532	A457-V534 HydrophobicContact CB-CG1 4.11Å; A457-V534 WeakPolarHBondContact O-CA 3.37Å; I458-V534 HydrophobicContact CG1-CG1 4.04Å; Y475-V534 HydrophobicContact CE1-CG1 3.87Å; L497-V534 HydrophobicContact CD1-CG1 4.27Å; L497-V534 HydrophobicContact CD1-CG2 3.78Å; M530-V534 WeakPolarHBondContact O-CG1 3.47Å; M530-V534 WeakPolarHBondContact O-CG2 3.41Å; M530-V534 PolarHBondContact O-N 2.97Å; G531-V534 WeakPolarHBondContact O-CG2 3.34Å; L532-V534 PolarHBondContact O-N 2.93Å
535	H	82.6	Confident	81.2	Confident	56 Å²	56	32.8 Å²	32.8	26%	0.259	18%	0.18	S	C	.	.	S	Bend	trans	-67.9	138.5	176.1	-171	-83.3	0	0	0	109.6	L532 L533 E537 A538 L642	L532-H535 VanDerWaalsContact O-CB 3.3Å; L532-H535 WeakPolarHBondContact O-CB 3.45Å; L532-H535 PolarHBondContact O-N 3.31Å; L533-H535 VanDerWaalsContact C-N 3.32Å; H535-E537 IonicContact CE1-OE2 3.87Å; H535-E537 PolarHBondContact ND1-N 2.96Å; H535-E537 PolarHBondContact O-N 3.18Å; H535-E537 VanDerWaalsContact O-N 3.11Å; H535-A538 WeakPolarHBondContact O-CB 3.47Å; H535-A538 PolarHBondContact O-N 3.05Å; H535-L642 HydrophobicContact CB-CD2 3.64Å
536	E	71.9	Confident	80.4	Confident	164 Å²	164	32.8 Å²	32.8	77%	0.766	18%	0.18	S	C	*	.	G	3₁₀ helix	trans	-55.1	-37.8	-173	-64.5	172.6	-178.7	0	0	112.7	A538 V539	E536-A538 VanDerWaalsContact C-N 3.27Å; E536-A538 PolarHBondContact O-N 3.36Å; E536-V539 VanDerWaalsContact O-CG1 3.28Å; E536-V539 WeakPolarHBondContact O-CG1 3.39Å; E536-V539 PolarHBondContact O-N 3.46Å
537	E	75.1	Confident	79.4	Confident	38 Å²	38	35.9 Å²	35.9	18%	0.178	20%	0.2	C	C	.	.	G	3₁₀ helix	trans	-74.7	-11.8	179	-59.3	-176.8	168.2	0	0	114.6	H535 V539 H540 A638 R641	H535-E537 IonicContact CE1-OE2 3.87Å; H535-E537 PolarHBondContact ND1-N 2.96Å; H535-E537 PolarHBondContact O-N 3.18Å; H535-E537 VanDerWaalsContact O-N 3.11Å; E537-V539 PolarHBondContact O-N 3.24Å; E537-H540 PolarHBondContact O-CD2 3.47Å; E537-A638 HydrophobicContact CB-CB 3.79Å; E537-A638 WeakPolarHBondContact OE2-CA 3.32Å; E537-R641 VanDerWaalsContact CD-CD 3.4Å; E537-R641 WeakPolarHBondContact OE1-CD 3.43Å; E537-R641 IonicContact OE1-CZ 2.93Å; E537-R641 IonicContact OE1-NE 2.88Å; E537-R641 IonicContact OE1-NH1 2.62Å; E537-R641 PolarHBondContact OE1-NH1 2.69Å; E537-R641 WeakPolarHBondContact OE2-CB 3.27Å; E537-R641 WeakPolarHBondContact OE2-CD 3.4Å
538	A	78.4	Confident	78.5	Confident	0 Å²	0	36.1 Å²	36.1	0%	0	21%	0.21	C	C	.	.	G	3₁₀ helix	trans	-69.2	-12.2	175.2	0	0	0	0	0	112.5	L532 H535 E536 H540 F541 T542 L642	L532-A538 VanDerWaalsContact O-CB 3.3Å; L532-A538 WeakPolarHBondContact O-CB 3.14Å; H535-A538 WeakPolarHBondContact O-CB 3.47Å; H535-A538 PolarHBondContact O-N 3.05Å; E536-A538 VanDerWaalsContact C-N 3.27Å; E536-A538 PolarHBondContact O-N 3.36Å; A538-H540 PolarHBondContact O-N 3.45Å; A538-F541 PolarHBondContact O-N 3.49Å; A538-T542 HydrophobicContact CB-CG2 4.33Å; A538-T542 WeakPolarHBondContact O-CG2 3.42Å; A538-T542 PolarHBondContact O-N 2.94Å; A538-T542 PolarHBondContact O-OG1 2.89Å; A538-L642 HydrophobicContact CB-CD1 4.29Å; A538-L642 HydrophobicContact CB-CD2 4.33Å
539	V	70.2	Confident	77.8	Confident	71 Å²	71	38.3 Å²	38.3	43%	0.43	22%	0.224	S	C	.	.	G	3₁₀ helix	trans	-50.8	-29.7	173.5	70.5	0	0	0	0	113.2	F460 E536 E537 F541 T542	F460-V539 HydrophobicContact CD2-CB 4.05Å; F460-V539 HydrophobicContact CD2-CG2 3.78Å; F460-V539 HydrophobicContact CE2-CB 3.66Å; F460-V539 HydrophobicContact CE2-CG2 3.94Å; F460-V539 HydrophobicContact CG-CG2 4.36Å; F460-V539 HydrophobicContact CZ-CB 4.13Å; E536-V539 VanDerWaalsContact O-CG1 3.28Å; E536-V539 WeakPolarHBondContact O-CG1 3.39Å; E536-V539 PolarHBondContact O-N 3.46Å; E537-V539 PolarHBondContact O-N 3.24Å; V539-F541 VanDerWaalsContact C-N 3.25Å; V539-F541 PolarHBondContact O-N 3.07Å; V539-T542 VanDerWaalsContact CA-OG1 3.25Å; V539-T542 WeakPolarHBondContact CA-OG1 3.48Å
540	H	70.1	Confident	77	Confident	68 Å²	68	39.9 Å²	39.9	32%	0.315	24%	0.236	S	C	.	.	G	3₁₀ helix	trans	-69.7	-20.5	177.8	-63.8	-58.4	0	0	0	114.1	E537 A538 Y569	E537-H540 PolarHBondContact O-CD2 3.47Å; A538-H540 PolarHBondContact O-N 3.45Å; H540-Y569 WeakPolarHBondContact O-CE1 3.48Å; H540-Y569 PolarHBondContact O-OH 3.45Å
541	F	77.2	Confident	76.2	Confident	15 Å²	15	41.2 Å²	41.2	7%	0.066	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-116.9	-12.5	-173.2	-54.9	-82.8	0	0	0	112.8	A538 V539 A543 L568 L572 F618 W619 A622 A638 A639 L642	A538-F541 PolarHBondContact O-N 3.49Å; V539-F541 VanDerWaalsContact C-N 3.25Å; V539-F541 PolarHBondContact O-N 3.07Å; F541-A543 PolarHBondContact O-N 3.19Å; F541-L568 HydrophobicContact CE1-CD1 4.43Å; F541-L572 HydrophobicContact CB-CD2 3.82Å; F541-F618 HydrophobicContact CD1-CZ 4.25Å; F541-W619 HydrophobicContact CB-CH2 4.34Å; F541-W619 HydrophobicContact CD1-CZ3 4.22Å; F541-W619 AromaticContact CD2-CH2 3.87Å; F541-W619 HydrophobicContact CD2-CH2 3.87Å; F541-W619 AromaticContact CD2-CZ3 3.58Å; F541-W619 HydrophobicContact CD2-CZ3 3.58Å; F541-W619 HydrophobicContact CE1-CZ3 4.28Å; F541-W619 HydrophobicContact CE2-CH2 4.4Å; F541-W619 AromaticContact CE2-CZ3 3.67Å; F541-W619 HydrophobicContact CE2-CZ3 3.67Å; F541-W619 HydrophobicContact CG-CH2 4.04Å; F541-W619 AromaticContact CG-CZ3 3.88Å; F541-W619 HydrophobicContact CG-CZ3 3.88Å; F541-W619 HydrophobicContact CZ-CZ3 4.03Å; F541-A622 HydrophobicContact CE1-CB 4.08Å; F541-A622 HydrophobicContact CZ-CB 4.47Å; F541-A638 HydrophobicContact CE2-CB 4.2Å; F541-A639 HydrophobicContact CZ-CB 3.93Å; F541-L642 HydrophobicContact CD2-CD1 3.98Å; F541-L642 HydrophobicContact CE2-CD1 3.98Å
542	T	72.3	Confident	75.5	Confident	25 Å²	25	44.4 Å²	44.4	15%	0.153	26%	0.264	C	S	.	.			trans	-91.9	91.4	-177.3	47.2	0	0	0	0	110.3	I458 L533 A538 V539	I458-T542 HydrophobicContact CG2-CG2 4.38Å; I458-T542 WeakPolarHBondContact O-CB 3.16Å; I458-T542 WeakPolarHBondContact O-CG2 3.48Å; I458-T542 PolarHBondContact O-OG1 2.83Å; L533-T542 HydrophobicContact CB-CG2 4.5Å; L533-T542 HydrophobicContact CD2-CG2 3.82Å; A538-T542 HydrophobicContact CB-CG2 4.33Å; A538-T542 WeakPolarHBondContact O-CG2 3.42Å; A538-T542 PolarHBondContact O-N 2.94Å; A538-T542 PolarHBondContact O-OG1 2.89Å; V539-T542 VanDerWaalsContact CA-OG1 3.25Å; V539-T542 WeakPolarHBondContact CA-OG1 3.48Å
543	A	71.2	Confident	74.8	Confident	34 Å²	34	45 Å²	45	28%	0.281	27%	0.267	S	S	.	.			trans	-119.5	141.1	169.7	0	0	0	0	0	109.3	F541 V545 P547 L553 Y569	F541-A543 PolarHBondContact O-N 3.19Å; A543-V545 VanDerWaalsContact C-N 3.29Å; A543-V545 WeakPolarHBondContact CB-O 3.42Å; A543-P547 HydrophobicContact CB-CG 4.24Å; A543-L553 HydrophobicContact CB-CD1 4.13Å; A543-L553 VanDerWaalsContact O-CD1 3.24Å; A543-L553 WeakPolarHBondContact O-CD1 3.48Å; A543-Y569 HydrophobicContact CB-CD1 4.04Å; A543-Y569 HydrophobicContact CB-CE1 4.2Å
544	S	69	Low	74.1	Confident	86 Å²	86	46.7 Å²	46.7	60%	0.601	28%	0.276	S	S	*	.	S	Bend	trans	-75	-27.2	170.3	54.4	0	0	0	0	111.6	L553	S544-L553 PolarHBondContact O-N 3.42Å
545	V	72	Confident	73.2	Confident	59 Å²	59	47.8 Å²	47.8	36%	0.358	28%	0.284	S	S	.	.	B	Isolated β-bridge	trans	-129.5	138.4	-178.5	175.4	0	0	0	0	108.5	A543 P547 S550	A543-V545 VanDerWaalsContact C-N 3.29Å; A543-V545 WeakPolarHBondContact CB-O 3.42Å; V545-P547 VanDerWaalsContact O-CD 3.28Å; V545-P547 WeakPolarHBondContact O-CD 3.41Å; V545-S550 VanDerWaalsContact CG1-CA 3.44Å; V545-S550 WeakPolarHBondContact CG1-O 3.5Å
546	C	73	Confident	71.9	Confident	0 Å²	0	51 Å²	51	0%	0	31%	0.308	C	S	.	.			trans	-60.4	121.3	177.5	-179.9	0	0	0	0	110.6	A548 C549 S550 V551 L553 H570	C546-A548 PolarHBondContact O-N 2.87Å; C546-A548 VanDerWaalsContact O-N 3.11Å; C546-C549 WeakPolarHBondContact CB-SG 3.45Å; C546-S550 VanDerWaalsContact O-CA 3.25Å; C546-S550 WeakPolarHBondContact O-CA 3.37Å; C546-S550 PolarHBondContact O-N 3.43Å; C546-V551 PolarHBondContact N-O 3.11Å; C546-L553 HydrophobicContact CB-CD1 4.46Å; C546-L553 HydrophobicContact CB-CD2 3.92Å; C546-L553 HydrophobicContact CB-CG 4.17Å; C546-H570 PolarHBondContact SG-NE2 3.43Å
547	P	68.6	Low	70.7	Confident	67 Å²	67	48.1 Å²	48.1	44%	0.435	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61	-23.1	179.9	-25.9	35.8	0	0	0	114	A543 V545 Y569	A543-P547 HydrophobicContact CB-CG 4.24Å; V545-P547 VanDerWaalsContact O-CD 3.28Å; V545-P547 WeakPolarHBondContact O-CD 3.41Å; P547-Y569 HydrophobicContact CG-CD1 4.47Å; P547-Y569 HydrophobicContact CG-CD2 4.22Å; P547-Y569 HydrophobicContact CG-CE1 4.15Å; P547-Y569 HydrophobicContact CG-CE2 3.87Å
548	A	69.9	Low	69.6	Low	43 Å²	43	51.7 Å²	51.7	36%	0.355	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.2	-44	-176.7	0	0	0	0	0	113.9	C546 A565	C546-A548 PolarHBondContact O-N 2.87Å; C546-A548 VanDerWaalsContact O-N 3.11Å; A548-A565 HydrophobicContact CB-CB 3.81Å
549	C	76.2	Confident	68.4	Low	45 Å²	45	57.3 Å²	57.3	30%	0.304	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	-112	-2.4	-176.4	68.9	0	0	0	0	114.2	C546 V551 H570	C546-C549 WeakPolarHBondContact CB-SG 3.45Å; C549-V551 HydrophobicContact CB-CG2 4.39Å; C549-V551 PolarHBondContact O-N 3.38Å; C549-V551 VanDerWaalsContact O-N 3.12Å; C549-H570 PolarHBondContact SG-NE2 3Å
550	S	76.4	Confident	67.7	Low	36 Å²	36	58.6 Å²	58.6	25%	0.252	36%	0.364	S	S	.	.			trans	59.5	16.1	-178.2	-53.3	0	0	0	0	115.6	V545 C546	V545-S550 VanDerWaalsContact CG1-CA 3.44Å; V545-S550 WeakPolarHBondContact CG1-O 3.5Å; C546-S550 VanDerWaalsContact O-CA 3.25Å; C546-S550 WeakPolarHBondContact O-CA 3.37Å; C546-S550 PolarHBondContact O-N 3.43Å
551	V	73.3	Confident	67.2	Low	30 Å²	30	57.8 Å²	57.8	18%	0.182	37%	0.365	C	S	.	.			trans	-79.4	134.8	175	175.1	0	0	0	0	110.3	C546 C549 L553 P561	C546-V551 PolarHBondContact N-O 3.11Å; C549-V551 HydrophobicContact CB-CG2 4.39Å; C549-V551 PolarHBondContact O-N 3.38Å; C549-V551 VanDerWaalsContact O-N 3.12Å; V551-L553 PolarHBondContact O-N 3.44Å; V551-P561 HydrophobicContact CG2-CG 4.12Å
552	P	73.8	Confident	66.9	Low	72 Å²	72	65.6 Å²	65.6	47%	0.468	40%	0.401	S	S	.	.	B	Isolated β-bridge	trans	-57.2	126	171.1	-22.9	33.6	0	0	0	110.7	S555	P552-S555 PolarHBondContact O-OG 3.26Å
553	L	76	Confident	67.1	Low	12 Å²	12	65.2 Å²	65.2	6%	0.063	40%	0.399	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.6	-26.4	-171.6	-76.6	165.5	0	0	0	113.1	A543 S544 C546 V551 A573	A543-L553 HydrophobicContact CB-CD1 4.13Å; A543-L553 VanDerWaalsContact O-CD1 3.24Å; A543-L553 WeakPolarHBondContact O-CD1 3.48Å; S544-L553 PolarHBondContact O-N 3.42Å; C546-L553 HydrophobicContact CB-CD1 4.46Å; C546-L553 HydrophobicContact CB-CD2 3.92Å; C546-L553 HydrophobicContact CB-CG 4.17Å; V551-L553 PolarHBondContact O-N 3.44Å; L553-A573 HydrophobicContact CB-CB 3.74Å; L553-A573 HydrophobicContact CD2-CB 4.03Å; L553-A573 HydrophobicContact CG-CB 4.41Å; L553-A573 WeakPolarHBondContact O-CB 3.11Å
554	L	72.7	Confident	67.3	Low	44 Å²	44	67.9 Å²	67.9	23%	0.23	41%	0.414	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.6	18.7	-173.5	-56.7	176.3	0	0	0	114.3	A573 R576	L554-A573 HydrophobicContact CD2-CB 4.47Å; L554-R576 HydrophobicContact CD2-CG 4.37Å
555	S	66.9	Low	67.3	Low	39 Å²	39	66 Å²	66	27%	0.273	40%	0.403	S	S	.	.			trans	-85.8	125.2	174.6	59.2	0	0	0	0	111.4	P552 S557	P552-S555 PolarHBondContact O-OG 3.26Å; S555-S557 VanDerWaalsContact C-N 3.26Å; S555-S557 PolarHBondContact O-N 2.92Å
556	T	56.1	Low	67.4	Low	124 Å²	124	63.2 Å²	63.2	76%	0.761	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.9	-9.6	-177.4	49.7	0	0	0	0	114.9	L577	T556-L577 HydrophobicContact CG2-CD2 4.22Å
557	S	47.2	Very low	67.8	Low	102 Å²	102	66.1 Å²	66.1	71%	0.713	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.7	11.4	-160.4	53.5	0	0	0	0	116.4	S555	S555-S557 VanDerWaalsContact C-N 3.26Å; S555-S557 PolarHBondContact O-N 2.92Å
558	Q	50.9	Low	68.4	Low	113 Å²	113	63.2 Å²	63.2	53%	0.528	38%	0.381	S	S	.	.			trans	-125.7	131	-177	-64.7	-175.4	-0.4	0	0	112.5	M560	Q558-M560 PolarHBondContact O-N 3.31Å
559	S	52.9	Low	69	Low	118 Å²	118	63.1 Å²	63.1	83%	0.825	37%	0.372	S	S	*	.	P	Polyproline II helix	trans	-56.9	124.7	160.5	54.8	0	0	0	0	108.4
560	M	55.8	Low	69.3	Low	98 Å²	98	61.4 Å²	61.4	48%	0.483	36%	0.359	S	S	.	.	P	Polyproline II helix	trans	-55.2	122.5	-173.1	-76.7	-77.3	-93.2	0	0	111.9	Q558 H562 H570	Q558-M560 PolarHBondContact O-N 3.31Å; M560-H562 PolarHBondContact O-N 3.34Å; M560-H570 HydrophobicContact CE-CB 3.32Å; M560-H570 WeakPolarHBondContact CE-O 3.4Å
561	P	60.3	Low	69.8	Low	51 Å²	51	61.4 Å²	61.4	33%	0.331	35%	0.354	S	S	.	.	P	Polyproline II helix	trans	-65.9	134.5	172.1	22.9	-26.6	0	0	0	109.2	V551 C563	V551-P561 HydrophobicContact CG2-CG 4.12Å; P561-C563 PolarHBondContact O-N 2.85Å
562	H	70.2	Confident	70.5	Confident	180 Å²	180	60.5 Å²	60.5	83%	0.833	35%	0.348	S	S	*	.			trans	-63.7	100.2	174.1	-162.4	-36.8	0	0	0	108.4	M560 P564	M560-H562 PolarHBondContact O-N 3.34Å; H562-P564 WeakPolarHBondContact O-CD 3.46Å
563	C	75.7	Confident	71	Confident	16 Å²	16	57.5 Å²	57.5	11%	0.108	33%	0.329	C	S	.	.			trans	-120	83.7	-174	-175.2	0	0	0	0	110.1	P561 A565 G566 H567	P561-C563 PolarHBondContact O-N 2.85Å; C563-A565 VanDerWaalsContact C-N 3.29Å; C563-A565 PolarHBondContact O-N 3.16Å; C563-G566 CarbonylContact O-C 3.57Å; C563-G566 PolarHBondContact O-N 3.25Å; C563-G566 PolarHBondContact SG-N 3.44Å; C563-G566 VanDerWaalsContact SG-N 3.42Å; C563-H567 WeakPolarHBondContact O-CA 3.5Å; C563-H567 WeakPolarHBondContact O-CB 3.45Å; C563-H567 PolarHBondContact O-N 3.4Å
564	P	76.3	Confident	71.5	Confident	91 Å²	91	59.3 Å²	59.3	59%	0.591	34%	0.337	S	S	*	.	G	3₁₀ helix	trans	-57.7	-41.2	-178.1	-22.6	32.2	0	0	0	112.7	H562 G566 H567	H562-P564 WeakPolarHBondContact O-CD 3.46Å; P564-G566 VanDerWaalsContact C-N 3.32Å; P564-G566 PolarHBondContact O-N 3.45Å; P564-H567 PolarHBondContact O-ND1 2.88Å
565	A	69.1	Low	72.2	Confident	46 Å²	46	57.4 Å²	57.4	38%	0.38	33%	0.327	S	S	.	.	G	3₁₀ helix	trans	-73.6	-20	-177.8	0	0	0	0	0	114.1	A548 C563	A548-A565 HydrophobicContact CB-CB 3.81Å; C563-A565 VanDerWaalsContact C-N 3.29Å; C563-A565 PolarHBondContact O-N 3.16Å
566	G	73.2	Confident	73.2	Confident	1 Å²	1	56.2 Å²	56.2	1%	0.01	32%	0.317	C	S	.	.	G	3₁₀ helix	trans	-120.1	13.4	-179	0	0	0	0	0	114.1	C563 P564 L568 Y569 H570	C563-G566 CarbonylContact O-C 3.57Å; C563-G566 PolarHBondContact O-N 3.25Å; C563-G566 PolarHBondContact SG-N 3.44Å; C563-G566 VanDerWaalsContact SG-N 3.42Å; P564-G566 VanDerWaalsContact C-N 3.32Å; P564-G566 PolarHBondContact O-N 3.45Å; G566-L568 VanDerWaalsContact C-N 3.25Å; G566-L568 PolarHBondContact O-N 3.46Å; G566-Y569 PolarHBondContact O-N 3.21Å; G566-Y569 VanDerWaalsContact O-N 3.1Å; G566-H570 PolarHBondContact O-CD2 3.47Å; G566-H570 VanDerWaalsContact O-CD2 3.29Å; G566-H570 PolarHBondContact O-N 2.87Å
567	H	81.3	Confident	74.6	Confident	60 Å²	60	52 Å²	52	28%	0.278	29%	0.29	S	S	.	.	H	α-helix	trans	-59.8	-32.2	-168.1	72.9	-83.8	0	0	0	113.3	C563 P564 H570 R571	C563-H567 WeakPolarHBondContact O-CA 3.5Å; C563-H567 WeakPolarHBondContact O-CB 3.45Å; C563-H567 PolarHBondContact O-N 3.4Å; P564-H567 PolarHBondContact O-ND1 2.88Å; H567-H570 WeakPolarHBondContact O-CB 3.47Å; H567-H570 PolarHBondContact O-N 2.75Å; H567-R571 VanDerWaalsContact O-CB 3.28Å; H567-R571 WeakPolarHBondContact O-CB 3.29Å; H567-R571 PolarHBondContact O-N 3.34Å
568	L	82.1	Confident	76.3	Confident	6 Å²	6	50 Å²	50	3%	0.031	27%	0.266	C	S	.	.	H	α-helix	trans	-66.6	-44.8	176	-67.9	-170.9	0	0	0	112.3	F541 G566 H570 R571 L572 F618 A622 I628	F541-L568 HydrophobicContact CE1-CD1 4.43Å; G566-L568 VanDerWaalsContact C-N 3.25Å; G566-L568 PolarHBondContact O-N 3.46Å; L568-H570 VanDerWaalsContact C-N 3.26Å; L568-H570 PolarHBondContact O-N 2.81Å; L568-R571 PolarHBondContact O-N 2.85Å; L568-L572 WeakPolarHBondContact O-CB 3.49Å; L568-L572 PolarHBondContact O-N 3.15Å; L568-F618 HydrophobicContact CB-CE2 3.91Å; L568-F618 HydrophobicContact CB-CZ 4.36Å; L568-F618 HydrophobicContact CD2-CD2 4.25Å; L568-F618 HydrophobicContact CD2-CE2 3.85Å; L568-F618 HydrophobicContact CG-CE2 4.4Å; L568-F618 VanDerWaalsContact O-CE2 3.23Å; L568-F618 WeakPolarHBondContact O-CE2 3.36Å; L568-A622 HydrophobicContact CD1-CB 3.78Å; L568-A622 HydrophobicContact CD2-CB 4.48Å; L568-I628 HydrophobicContact CD1-CD1 3.39Å; L568-I628 HydrophobicContact CG-CD1 4.21Å
569	Y	82.4	Confident	77.9	Confident	42 Å²	42	44.6 Å²	44.6	17%	0.165	24%	0.241	C	C	.	.	H	α-helix	trans	-59.5	-44	177	-64.7	-77.9	0	0	0	111.1	H540 A543 P547 G566 A573	H540-Y569 WeakPolarHBondContact O-CE1 3.48Å; H540-Y569 PolarHBondContact O-OH 3.45Å; A543-Y569 HydrophobicContact CB-CD1 4.04Å; A543-Y569 HydrophobicContact CB-CE1 4.2Å; P547-Y569 HydrophobicContact CG-CD1 4.47Å; P547-Y569 HydrophobicContact CG-CD2 4.22Å; P547-Y569 HydrophobicContact CG-CE1 4.15Å; P547-Y569 HydrophobicContact CG-CE2 3.87Å; G566-Y569 PolarHBondContact O-N 3.21Å; G566-Y569 VanDerWaalsContact O-N 3.1Å; Y569-A573 VanDerWaalsContact O-CB 3.3Å; Y569-A573 WeakPolarHBondContact O-CB 3.4Å; Y569-A573 PolarHBondContact O-N 3.49Å
570	H	83.5	Confident	79.2	Confident	8 Å²	8	40.2 Å²	40.2	4%	0.037	21%	0.208	C	C	.	.	H	α-helix	trans	-60.6	-47	175.2	-85.7	-56.1	0	0	0	112.8	C546 C549 M560 G566 H567 L568 A573 E574	C546-H570 PolarHBondContact SG-NE2 3.43Å; C549-H570 PolarHBondContact SG-NE2 3Å; M560-H570 HydrophobicContact CE-CB 3.32Å; M560-H570 WeakPolarHBondContact CE-O 3.4Å; G566-H570 PolarHBondContact O-CD2 3.47Å; G566-H570 VanDerWaalsContact O-CD2 3.29Å; G566-H570 PolarHBondContact O-N 2.87Å; H567-H570 WeakPolarHBondContact O-CB 3.47Å; H567-H570 PolarHBondContact O-N 2.75Å; L568-H570 VanDerWaalsContact C-N 3.26Å; L568-H570 PolarHBondContact O-N 2.81Å; H570-A573 PolarHBondContact O-N 2.68Å; H570-E574 WeakPolarHBondContact O-CB 3.01Å; H570-E574 PolarHBondContact O-N 3.19Å
571	R	86.2	Confident	80.3	Confident	36 Å²	36	39.1 Å²	39.1	14%	0.136	20%	0.202	C	C	.	.	H	α-helix	trans	-68.2	-38.1	179.9	-172.1	172.1	173.6	-155.3	2.2	112.7	H567 L568 E574 L575 E614 F618 D621	H567-R571 VanDerWaalsContact O-CB 3.28Å; H567-R571 WeakPolarHBondContact O-CB 3.29Å; H567-R571 PolarHBondContact O-N 3.34Å; L568-R571 PolarHBondContact O-N 2.85Å; R571-E574 WeakPolarHBondContact O-CB 3.45Å; R571-E574 PolarHBondContact O-N 3.21Å; R571-L575 WeakPolarHBondContact O-CG 3.35Å; R571-L575 PolarHBondContact O-N 3.44Å; R571-E614 IonicContact CZ-OE1 2.88Å; R571-E614 IonicContact NE-OE1 2.9Å; R571-E614 PolarHBondContact NE-OE1 2.8Å; R571-E614 IonicContact NH2-OE1 2.89Å; R571-E614 PolarHBondContact NH2-OE1 3.29Å; R571-F618 HydrophobicContact CB-CD2 4.2Å; R571-F618 HydrophobicContact CB-CE2 4.45Å; R571-F618 HydrophobicContact CG-CD2 4.07Å; R571-D621 IonicContact CZ-OD2 2.76Å; R571-D621 IonicContact NH1-OD2 3.55Å; R571-D621 PolarHBondContact NH1-OD2 3.06Å; R571-D621 IonicContact NH2-OD2 2.8Å; R571-D621 PolarHBondContact NH2-OD2 3.03Å
572	L	87.1	Confident	81	Confident	12 Å²	12	36.9 Å²	36.9	6%	0.063	19%	0.188	C	C	.	.	H	α-helix	trans	-65.7	-41.4	174.5	-175.7	60.1	0	0	0	111.4	L529 L533 F541 L568 E574 L575 R576 F618	L529-L572 HydrophobicContact CD1-CD1 4.42Å; L533-L572 HydrophobicContact CD2-CD2 4.11Å; F541-L572 HydrophobicContact CB-CD2 3.82Å; L568-L572 WeakPolarHBondContact O-CB 3.49Å; L568-L572 PolarHBondContact O-N 3.15Å; L572-E574 VanDerWaalsContact C-N 3.35Å; L572-L575 PolarHBondContact O-N 3.41Å; L572-R576 PolarHBondContact O-N 3.11Å; L572-F618 HydrophobicContact CB-CE1 4.28Å; L572-F618 HydrophobicContact CB-CE2 3.93Å; L572-F618 HydrophobicContact CB-CZ 3.74Å; L572-F618 HydrophobicContact CD1-CD1 4.25Å; L572-F618 HydrophobicContact CD1-CE1 3.91Å; L572-F618 HydrophobicContact CD1-CZ 4.25Å; L572-F618 HydrophobicContact CD2-CE1 4.33Å; L572-F618 HydrophobicContact CD2-CZ 4.2Å; L572-F618 HydrophobicContact CG-CE1 4.4Å; L572-F618 HydrophobicContact CG-CZ 4.29Å
573	A	85.1	Confident	80.9	Confident	9 Å²	9	29.7 Å²	29.7	7%	0.074	16%	0.159	C	C	.	.	H	α-helix	trans	-65	-38.7	175.4	0	0	0	0	0	112.3	L553 L554 Y569 H570 R576 L577	L553-A573 HydrophobicContact CB-CB 3.74Å; L553-A573 HydrophobicContact CD2-CB 4.03Å; L553-A573 HydrophobicContact CG-CB 4.41Å; L553-A573 WeakPolarHBondContact O-CB 3.11Å; L554-A573 HydrophobicContact CD2-CB 4.47Å; Y569-A573 VanDerWaalsContact O-CB 3.3Å; Y569-A573 WeakPolarHBondContact O-CB 3.4Å; Y569-A573 PolarHBondContact O-N 3.49Å; H570-A573 PolarHBondContact O-N 2.68Å; A573-R576 WeakPolarHBondContact O-CB 3.38Å; A573-R576 PolarHBondContact O-N 2.9Å; A573-L577 WeakPolarHBondContact O-CB 3.26Å; A573-L577 VanDerWaalsContact O-CG 3.32Å; A573-L577 WeakPolarHBondContact O-CG 3.05Å; A573-L577 PolarHBondContact O-N 3.35Å
574	E	85.6	Confident	80.2	Confident	49 Å²	49	32.3 Å²	32.3	23%	0.229	18%	0.177	C	C	.	.	H	α-helix	trans	-60.5	-48.8	173.3	-174.4	-172.9	-174	0	0	111.2	H570 R571 L572 R576 L577 Y578 R604	H570-E574 WeakPolarHBondContact O-CB 3.01Å; H570-E574 PolarHBondContact O-N 3.19Å; R571-E574 WeakPolarHBondContact O-CB 3.45Å; R571-E574 PolarHBondContact O-N 3.21Å; L572-E574 VanDerWaalsContact C-N 3.35Å; E574-R576 PolarHBondContact O-N 3.38Å; E574-L577 PolarHBondContact O-N 3.39Å; E574-Y578 HydrophobicContact CG-CD2 3.7Å; E574-Y578 HydrophobicContact CG-CE2 3.38Å; E574-Y578 WeakPolarHBondContact O-CD2 3.34Å; E574-Y578 PolarHBondContact O-N 2.86Å; E574-Y578 WeakPolarHBondContact OE1-CE2 3.47Å; E574-R604 IonicContact OE1-NH1 3.63Å; E574-R604 PolarHBondContact OE1-NH1 3.39Å; E574-R604 IonicContact OE2-NH1 2.77Å; E574-R604 PolarHBondContact OE2-NH1 3.49Å
575	L	88.5	Confident	78.9	Confident	4 Å²	4	31.8 Å²	31.8	2%	0.021	17%	0.173	C	C	.	.	H	α-helix	trans	-56.8	-38.4	175.7	-75.1	170.2	0	0	0	112.3	R571 L572 L579 F605 W611 E614 V615 F618	R571-L575 WeakPolarHBondContact O-CG 3.35Å; R571-L575 PolarHBondContact O-N 3.44Å; L572-L575 PolarHBondContact O-N 3.41Å; L575-L579 PolarHBondContact O-N 2.82Å; L575-F605 HydrophobicContact CD2-CE2 4.4Å; L575-F605 HydrophobicContact CD2-CZ 4.4Å; L575-W611 PolarHBondContact O-NE1 2.99Å; L575-E614 HydrophobicContact CD2-CB 3.91Å; L575-E614 HydrophobicContact CD2-CG 3.78Å; L575-V615 HydrophobicContact CD1-CG2 4.03Å; L575-V615 HydrophobicContact CD2-CG2 4.17Å; L575-F618 HydrophobicContact CD1-CB 3.89Å; L575-F618 HydrophobicContact CD1-CG 4.23Å
576	R	87.8	Confident	77.9	Confident	15 Å²	15	33.8 Å²	33.8	6%	0.057	18%	0.182	C	C	.	.	H	α-helix	trans	-69.3	-49.6	175.9	179.6	175.3	163	169.6	6.1	112.4	D478 L481 L529 L554 L572 A573 E574 Y578 L579 E580	D478-R576 PolarHBondContact O-NH2 3.02Å; L481-R576 HydrophobicContact CD2-CG 4.08Å; L529-R576 HydrophobicContact CD2-CB 3.85Å; L529-R576 HydrophobicContact CD2-CG 3.94Å; L554-R576 HydrophobicContact CD2-CG 4.37Å; L572-R576 PolarHBondContact O-N 3.11Å; A573-R576 WeakPolarHBondContact O-CB 3.38Å; A573-R576 PolarHBondContact O-N 2.9Å; E574-R576 PolarHBondContact O-N 3.38Å; R576-Y578 VanDerWaalsContact C-N 3.27Å; R576-Y578 PolarHBondContact O-N 2.91Å; R576-L579 WeakPolarHBondContact O-CB 2.82Å; R576-L579 PolarHBondContact O-N 3.35Å; R576-L579 VanDerWaalsContact O-N 3.13Å; R576-E580 IonicContact CZ-OE1 2.75Å; R576-E580 IonicContact NE-OE1 3.63Å; R576-E580 PolarHBondContact NE-OE1 3.09Å; R576-E580 IonicContact NH2-OE1 3.66Å; R576-E580 PolarHBondContact NH2-OE1 3.06Å; R576-E580 PolarHBondContact O-N 2.97Å
577	L	84.9	Confident	76.1	Confident	36 Å²	36	40.9 Å²	40.9	19%	0.188	22%	0.22	C	C	.	.	H	α-helix	trans	-61.4	-37.2	-179.8	-73.3	172.9	0	0	0	111.5	T556 A573 E574 E580 E581	T556-L577 HydrophobicContact CG2-CD2 4.22Å; A573-L577 WeakPolarHBondContact O-CB 3.26Å; A573-L577 VanDerWaalsContact O-CG 3.32Å; A573-L577 WeakPolarHBondContact O-CG 3.05Å; A573-L577 PolarHBondContact O-N 3.35Å; E574-L577 PolarHBondContact O-N 3.39Å; L577-E580 PolarHBondContact O-N 2.93Å; L577-E581 WeakPolarHBondContact O-CB 3.44Å; L577-E581 PolarHBondContact O-N 2.62Å
578	Y	83.2	Confident	73.6	Confident	58 Å²	58	41.6 Å²	41.6	23%	0.227	24%	0.244	C	C	.	.	H	α-helix	trans	-62.8	-42.7	173.2	-84	-56.1	0	0	0	113	E574 R576 E580 E581 A582 R604 F605	E574-Y578 HydrophobicContact CG-CD2 3.7Å; E574-Y578 HydrophobicContact CG-CE2 3.38Å; E574-Y578 WeakPolarHBondContact O-CD2 3.34Å; E574-Y578 PolarHBondContact O-N 2.86Å; E574-Y578 WeakPolarHBondContact OE1-CE2 3.47Å; R576-Y578 VanDerWaalsContact C-N 3.27Å; R576-Y578 PolarHBondContact O-N 2.91Å; Y578-E580 VanDerWaalsContact C-N 3.32Å; Y578-E581 PolarHBondContact O-N 2.88Å; Y578-A582 PolarHBondContact O-N 3.26Å; Y578-R604 HydrophobicContact CE1-CB 4.23Å; Y578-R604 HydrophobicContact CE2-CB 4.29Å; Y578-F605 HydrophobicContact CD2-CD2 4.14Å; Y578-F605 AromaticContact CD2-CE2 3.68Å; Y578-F605 HydrophobicContact CD2-CE2 3.68Å; Y578-F605 HydrophobicContact CE2-CE2 4.02Å; Y578-F605 HydrophobicContact CG-CD2 4.13Å; Y578-F605 HydrophobicContact CG-CE2 4.14Å
579	L	84.1	Confident	71.3	Confident	0 Å²	0	52.1 Å²	52.1	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-62.2	-42.5	176.1	-178	66.8	0	0	0	110.7	F517 Y522 L529 L575 R576 A582 W611	F517-L579 HydrophobicContact CD2-CD1 4.31Å; F517-L579 HydrophobicContact CE2-CD1 4.13Å; Y522-L579 HydrophobicContact CD2-CD1 4.05Å; Y522-L579 HydrophobicContact CD2-CG 4.35Å; Y522-L579 WeakPolarHBondContact CD2-O 3.49Å; Y522-L579 HydrophobicContact CE2-CD1 4.47Å; Y522-L579 HydrophobicContact CE2-CG 4.27Å; Y522-L579 WeakPolarHBondContact CE2-O 2.99Å; L529-L579 HydrophobicContact CB-CD2 4.3Å; L529-L579 HydrophobicContact CD2-CD2 4.09Å; L575-L579 PolarHBondContact O-N 2.82Å; R576-L579 WeakPolarHBondContact O-CB 2.82Å; R576-L579 PolarHBondContact O-N 3.35Å; R576-L579 VanDerWaalsContact O-N 3.13Å; L579-A582 WeakPolarHBondContact O-CB 3.31Å; L579-A582 PolarHBondContact O-N 3.34Å; L579-W611 HydrophobicContact CB-CZ2 4.41Å; L579-W611 HydrophobicContact CD2-CH2 4.32Å; L579-W611 HydrophobicContact CD2-CZ2 3.99Å
580	E	81.6	Confident	68.7	Low	27 Å²	27	54.8 Å²	54.8	13%	0.126	31%	0.308	C	S	.	.	H	α-helix	trans	-62.9	-40.8	174.8	-67.9	178.2	-172.3	0	0	112.2	L481 R483 R576 L577 Y578 A582 A583	L481-E580 HydrophobicContact CD2-CG 3.93Å; R483-E580 IonicContact CZ-OE2 3.8Å; R483-E580 VanDerWaalsContact CZ-OE2 3.28Å; R483-E580 IonicContact NE-OE1 2.63Å; R483-E580 IonicContact NE-OE2 3.49Å; R483-E580 PolarHBondContact NE-OE2 2.94Å; R483-E580 IonicContact NH2-OE2 3.78Å; R483-E580 PolarHBondContact NH2-OE2 2.8Å; R576-E580 IonicContact CZ-OE1 2.75Å; R576-E580 IonicContact NE-OE1 3.63Å; R576-E580 PolarHBondContact NE-OE1 3.09Å; R576-E580 IonicContact NH2-OE1 3.66Å; R576-E580 PolarHBondContact NH2-OE1 3.06Å; R576-E580 PolarHBondContact O-N 2.97Å; L577-E580 PolarHBondContact O-N 2.93Å; Y578-E580 VanDerWaalsContact C-N 3.32Å; E580-A582 VanDerWaalsContact C-N 3.32Å; E580-A582 PolarHBondContact O-N 3.35Å; E580-A583 PolarHBondContact O-N 3.05Å
581	E	78	Confident	66.1	Low	75 Å²	75	61.9 Å²	61.9	35%	0.35	35%	0.346	S	S	.	.	H	α-helix	trans	-67.2	-31.6	176.5	-163.9	-166.5	163.9	0	0	112.3	R516 L577 Y578 A583 S584	R516-E581 IonicContact CZ-OE1 3.47Å; R516-E581 IonicContact NH1-OE1 2.81Å; R516-E581 PolarHBondContact NH1-OE1 3.47Å; R516-E581 IonicContact NH1-OE2 3Å; R516-E581 IonicContact NH2-OE1 3.59Å; R516-E581 PolarHBondContact NH2-OE1 3.26Å; L577-E581 WeakPolarHBondContact O-CB 3.44Å; L577-E581 PolarHBondContact O-N 2.62Å; Y578-E581 PolarHBondContact O-N 2.88Å; E581-A583 PolarHBondContact O-N 3.11Å; E581-A583 VanDerWaalsContact O-N 3.1Å; E581-S584 WeakPolarHBondContact O-CB 2.78Å; E581-S584 PolarHBondContact O-N 3.43Å
582	A	74.3	Confident	63.3	Low	4 Å²	4	64.7 Å²	64.7	3%	0.033	37%	0.367	C	S	.	.	H	α-helix	trans	-60.5	-22.1	178.5	0	0	0	0	0	113.1	G515 R516 F517 Y578 L579 E580	G515-A582 CarbonylContact C-O 3.49Å; G515-A582 WeakPolarHBondContact CA-O 3.24Å; R516-A582 PolarHBondContact N-O 2.88Å; F517-A582 HydrophobicContact CB-CB 4.3Å; F517-A582 HydrophobicContact CD1-CB 4.26Å; F517-A582 HydrophobicContact CD2-CB 3.97Å; F517-A582 HydrophobicContact CE2-CB 4.35Å; F517-A582 HydrophobicContact CG-CB 3.92Å; Y578-A582 PolarHBondContact O-N 3.26Å; L579-A582 WeakPolarHBondContact O-CB 3.31Å; L579-A582 PolarHBondContact O-N 3.34Å; E580-A582 VanDerWaalsContact C-N 3.32Å; E580-A582 PolarHBondContact O-N 3.35Å
583	A	68.4	Low	60.7	Low	29 Å²	29	74.9 Å²	74.9	24%	0.24	41%	0.406	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83	-11	173	0	0	0	0	0	114.3	V513 Y522 E580 E581	V513-A583 WeakPolarHBondContact CG1-O 3.49Å; Y522-A583 HydrophobicContact CD1-CB 4.2Å; Y522-A583 HydrophobicContact CD2-CB 4.04Å; Y522-A583 HydrophobicContact CE1-CB 3.81Å; Y522-A583 HydrophobicContact CE2-CB 3.66Å; Y522-A583 HydrophobicContact CG-CB 4.29Å; E580-A583 PolarHBondContact O-N 3.05Å; E581-A583 PolarHBondContact O-N 3.11Å; E581-A583 VanDerWaalsContact O-N 3.1Å
584	S	61.9	Low	58	Low	70 Å²	70	79.8 Å²	79.8	49%	0.49	44%	0.44	S	S	.	.	S	Bend	trans	-87.8	139.7	-179.5	-61.2	0	0	0	0	111.2	E581	E581-S584 WeakPolarHBondContact O-CB 2.78Å; E581-S584 PolarHBondContact O-N 3.43Å
585	T	48.9	Very low	55.3	Low	80 Å²	80	83.2 Å²	83.2	49%	0.491	46%	0.46	S	S	.	.			trans	-63.2	143.5	173.1	48.8	0	0	0	0	110.5	V513 N587	V513-T585 HydrophobicContact CG1-CG2 3.94Å; T585-N587 PolarHBondContact O-N 3.34Å
586	P	48.3	Very low	52.8	Low	88 Å²	88	88.2 Å²	88.2	57%	0.571	49%	0.493	S	S	*	.	S	Bend	trans	-64.3	-3.9	175.2	-23.4	33.3	0	0	0	115.8
587	N	34.1	Very low	50.1	Low	150 Å²	150	97.2 Å²	97.2	80%	0.802	53%	0.528	S	S	*	.			trans	-118	95.8	-169.3	-74	-6.9	0	0	0	112.3	T585	T585-N587 PolarHBondContact O-N 3.34Å
588	G	29.7	Very low	47.5	Very low	76 Å²	76	103.7 Å²	103.7	78%	0.784	56%	0.555	S	S	*	*			trans	-161.5	12.9	171.7	0	0	0	0	0	115.1
589	R	33.7	Very low	44.9	Very low	227 Å²	227	107.2 Å²	107.2	86%	0.857	58%	0.578	S	S	*	*	S	Bend	trans	-125	112.9	168.2	-73	-171.7	177.8	-174.1	1	108.6	D591	R589-D591 PolarHBondContact O-N 3.16Å
590	S	27.8	Very low	42.6	Very low	98 Å²	98	111.7 Å²	111.7	69%	0.685	61%	0.609	S	S	*	*			trans	-47.4	119	172	171.8	0	0	0	0	109.8	T592	S590-T592 PolarHBondContact O-N 3.46Å; S590-T592 PolarHBondContact OG-OG1 2.66Å
591	D	28.4	Very low	40.4	Very low	156 Å²	156	117.4 Å²	117.4	83%	0.834	64%	0.641	S	S	*	*			trans	-66.8	61.9	172	-77.5	-41	0	0	0	111.3	R589	R589-D591 PolarHBondContact O-N 3.16Å
592	T	27.8	Very low	38.8	Very low	96 Å²	96	121.1 Å²	121.1	59%	0.589	66%	0.658	S	S	*	*	S	Bend	trans	-120.8	107.4	166.1	38.7	0	0	0	0	107.7	S590	S590-T592 PolarHBondContact O-N 3.46Å; S590-T592 PolarHBondContact OG-OG1 2.66Å
593	Y	32.6	Very low	37.5	Very low	226 Å²	226	124 Å²	124	89%	0.886	68%	0.677	S	S	*	*			trans	82.1	72.1	178.2	-56.4	-81.9	0	0	0	116.8	N595	Y593-N595 PolarHBondContact O-N 3.44Å; Y593-N595 VanDerWaalsContact O-N 3.17Å
594	S	28.9	Very low	37.3	Very low	111 Å²	111	128.1 Å²	128.1	78%	0.776	69%	0.687	S	S	*	*			trans	-62.1	108.6	155.5	-41.8	0	0	0	0	109.5
595	N	28.2	Very low	37.8	Very low	121 Å²	121	125.7 Å²	125.7	65%	0.647	67%	0.667	S	S	*	*			trans	-88.4	122.8	169.9	-169.3	-2.6	0	0	0	109	Y593 Y597	Y593-N595 PolarHBondContact O-N 3.44Å; Y593-N595 VanDerWaalsContact O-N 3.17Å; N595-Y597 VanDerWaalsContact C-N 3.28Å; N595-Y597 PolarHBondContact O-N 3.48Å; N595-Y597 VanDerWaalsContact O-N 3.17Å
596	P	37.4	Very low	38.9	Very low	110 Å²	110	127 Å²	127	71%	0.714	68%	0.675	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.8	2.4	-167.1	-11.3	27.4	0	0	0	116.1
597	Y	30.4	Very low	40.4	Very low	203 Å²	203	125 Å²	125	80%	0.796	66%	0.662	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.3	6.9	-171.5	-82.6	-78.8	0	0	0	115.6	N595	N595-Y597 VanDerWaalsContact C-N 3.28Å; N595-Y597 PolarHBondContact O-N 3.48Å; N595-Y597 VanDerWaalsContact O-N 3.17Å
598	F	29.8	Very low	42.9	Very low	172 Å²	172	118 Å²	118	75%	0.754	63%	0.625	S	S	*	*			trans	-135.9	68.7	175	-84.8	-84.3	0	0	0	111	S600	F598-S600 PolarHBondContact O-N 3.13Å
599	D	28.5	Very low	45.5	Very low	132 Å²	132	115.8 Å²	115.8	71%	0.706	60%	0.598	S	S	*	*			trans	-90.8	43.4	174.1	-151.5	11.4	0	0	0	111.7
600	S	36.5	Very low	48	Very low	94 Å²	94	107.7 Å²	107.7	66%	0.657	57%	0.571	S	S	*	*			trans	-95.4	8	176.5	52.2	0	0	0	0	113.5	F598 Q602	F598-S600 PolarHBondContact O-N 3.13Å; S600-Q602 VanDerWaalsContact C-N 3.34Å
601	N	35.5	Very low	51	Low	148 Å²	148	103.1 Å²	103.1	79%	0.791	54%	0.539	S	S	*	.			trans	-95.6	21.2	174.7	-90.7	12.7	0	0	0	113.2	C603	N601-C603 PolarHBondContact O-N 3.42Å; N601-C603 VanDerWaalsContact O-N 3.1Å
602	Q	43.4	Very low	53.9	Low	153 Å²	153	95.8 Å²	95.8	72%	0.715	50%	0.5	S	S	*	.			trans	-57.7	115.7	168.9	-106.6	176.2	8.2	0	0	110	S600 R604	S600-Q602 VanDerWaalsContact C-N 3.34Å; Q602-R604 PolarHBondContact O-N 3.2Å
603	C	48.4	Very low	56.8	Low	64 Å²	64	95.1 Å²	95.1	43%	0.432	49%	0.492	S	S	.	.			trans	-55.7	117.6	-179.3	-170.6	0	0	0	0	111	N601	N601-C603 PolarHBondContact O-N 3.42Å; N601-C603 VanDerWaalsContact O-N 3.1Å
604	R	62.9	Low	59.5	Low	116 Å²	116	85.4 Å²	85.4	44%	0.438	45%	0.454	S	S	.	.	S	Bend	trans	-79.7	-26.9	-169.5	-162.8	173	177.7	179.8	-4.7	114.5	E574 Y578 Q602 E614	E574-R604 IonicContact OE1-NH1 3.63Å; E574-R604 PolarHBondContact OE1-NH1 3.39Å; E574-R604 IonicContact OE2-NH1 2.77Å; E574-R604 PolarHBondContact OE2-NH1 3.49Å; Y578-R604 HydrophobicContact CE1-CB 4.23Å; Y578-R604 HydrophobicContact CE2-CB 4.29Å; Q602-R604 PolarHBondContact O-N 3.2Å; R604-E614 IonicContact NH2-OE1 3.67Å
605	F	72.1	Confident	62.3	Low	19 Å²	19	80.2 Å²	80.2	8%	0.083	42%	0.418	C	S	.	.			trans	-133	132.3	-177.2	-52.1	-64.5	0	0	0	111	L575 Y578 D610 W611 E614	L575-F605 HydrophobicContact CD2-CE2 4.4Å; L575-F605 HydrophobicContact CD2-CZ 4.4Å; Y578-F605 HydrophobicContact CD2-CD2 4.14Å; Y578-F605 AromaticContact CD2-CE2 3.68Å; Y578-F605 HydrophobicContact CD2-CE2 3.68Å; Y578-F605 HydrophobicContact CE2-CE2 4.02Å; Y578-F605 HydrophobicContact CG-CD2 4.13Å; Y578-F605 HydrophobicContact CG-CE2 4.14Å; F605-D610 HydrophobicContact CB-CB 4.21Å; F605-D610 HydrophobicContact CD1-CB 3.83Å; F605-D610 HydrophobicContact CG-CB 4.49Å; F605-W611 HydrophobicContact CB-CB 4.46Å; F605-W611 HydrophobicContact CG-CB 4.33Å; F605-E614 HydrophobicContact CE1-CB 3.83Å; F605-E614 HydrophobicContact CE1-CG 4.26Å; F605-E614 HydrophobicContact CZ-CB 3.84Å; F605-E614 HydrophobicContact CZ-CG 3.87Å
606	T	71.8	Confident	65.3	Low	108 Å²	108	75.3 Å²	75.3	66%	0.663	39%	0.392	S	S	*	.	S	Bend	trans	-105.4	-22.4	-177.9	60.5	0	0	0	0	113.2	D610	T606-D610 PolarHBondContact N-OD2 3.44Å; T606-D610 VanDerWaalsContact N-OD2 3.17Å; T606-D610 PolarHBondContact OG1-OD2 3.4Å
607	C	81.7	Confident	67.7	Low	44 Å²	44	74.6 Å²	74.6	30%	0.297	38%	0.378	S	S	.	.	S	Bend	trans	-143.4	164.8	177.8	56.9	0	0	0	0	111.4	F517 S609 D610 W611	F517-C607 WeakPolarHBondContact CZ-O 3.47Å; C607-S609 PolarHBondContact O-N 3.48Å; C607-S609 PolarHBondContact SG-OG 3.43Å; C607-D610 PolarHBondContact N-OD2 3.31Å; C607-D610 PolarHBondContact O-N 3.33Å; C607-D610 PolarHBondContact SG-OD1 2.84Å; C607-D610 PolarHBondContact SG-OD2 3.07Å; C607-W611 PolarHBondContact O-N 3.31Å
608	L	85.6	Confident	70.5	Confident	4 Å²	4	65 Å²	65	2%	0.021	34%	0.34	C	S	.	.	H	α-helix	trans	-58.3	-34	-179.8	178	64.1	0	0	0	112.6	F517 D521 A524 W611 L612 R654	F517-L608 HydrophobicContact CE2-CB 4.37Å; F517-L608 HydrophobicContact CE2-CD1 4.23Å; D521-L608 HydrophobicContact CB-CB 4.01Å; D521-L608 HydrophobicContact CB-CD2 4.17Å; A524-L608 HydrophobicContact CB-CD2 3.96Å; L608-W611 HydrophobicContact CD1-CE3 3.76Å; L608-W611 HydrophobicContact CD1-CZ3 4.19Å; L608-W611 PolarHBondContact O-N 2.7Å; L608-L612 HydrophobicContact CD1-CG 4.32Å; L608-L612 HydrophobicContact CG-CD1 4.06Å; L608-L612 HydrophobicContact CG-CG 4.26Å; L608-L612 WeakPolarHBondContact O-CB 3.49Å; L608-L612 WeakPolarHBondContact O-CG 3.4Å; L608-L612 PolarHBondContact O-N 3.35Å; L608-R654 HydrophobicContact CD2-CG 4.06Å
609	S	85.4	Confident	73.3	Confident	30 Å²	30	56.8 Å²	56.8	21%	0.21	30%	0.304	C	S	.	.	H	α-helix	trans	-64.4	-39.3	177.8	42.7	0	0	0	0	113.1	C607 W611 L612 I613	C607-S609 PolarHBondContact O-N 3.48Å; C607-S609 PolarHBondContact SG-OG 3.43Å; S609-W611 VanDerWaalsContact C-N 3.28Å; S609-W611 PolarHBondContact O-N 3.41Å; S609-L612 PolarHBondContact O-N 3.42Å; S609-I613 VanDerWaalsContact O-CG1 3.29Å; S609-I613 WeakPolarHBondContact O-CG1 3.41Å; S609-I613 PolarHBondContact O-N 3.35Å
610	D	86.2	Confident	76.1	Confident	57 Å²	57	51 Å²	51	31%	0.305	27%	0.274	S	S	.	.	H	α-helix	trans	-62.5	-42.1	176.7	-58.3	-28.4	0	0	0	110.4	F605 T606 C607 E614	F605-D610 HydrophobicContact CB-CB 4.21Å; F605-D610 HydrophobicContact CD1-CB 3.83Å; F605-D610 HydrophobicContact CG-CB 4.49Å; T606-D610 PolarHBondContact N-OD2 3.44Å; T606-D610 VanDerWaalsContact N-OD2 3.17Å; T606-D610 PolarHBondContact OG1-OD2 3.4Å; C607-D610 PolarHBondContact N-OD2 3.31Å; C607-D610 PolarHBondContact O-N 3.33Å; C607-D610 PolarHBondContact SG-OD1 2.84Å; C607-D610 PolarHBondContact SG-OD2 3.07Å; D610-E614 PolarHBondContact O-N 3.26Å
611	W	89.8	Confident	78.4	Confident	1 Å²	1	48.9 Å²	48.9	0%	0.004	26%	0.255	C	S	.	.	H	α-helix	trans	-66	-43.7	176.6	178.6	88.4	0	0	0	111.8	F517 L529 L575 L579 F605 C607 L608 S609 I613 E614 V615	F517-W611 HydrophobicContact CE2-CB 4.45Å; F517-W611 HydrophobicContact CZ-CB 4.07Å; L529-W611 HydrophobicContact CB-CH2 3.99Å; L529-W611 HydrophobicContact CB-CZ2 4.28Å; L529-W611 HydrophobicContact CD2-CZ2 4.25Å; L575-W611 PolarHBondContact O-NE1 2.99Å; L579-W611 HydrophobicContact CB-CZ2 4.41Å; L579-W611 HydrophobicContact CD2-CH2 4.32Å; L579-W611 HydrophobicContact CD2-CZ2 3.99Å; F605-W611 HydrophobicContact CB-CB 4.46Å; F605-W611 HydrophobicContact CG-CB 4.33Å; C607-W611 PolarHBondContact O-N 3.31Å; L608-W611 HydrophobicContact CD1-CE3 3.76Å; L608-W611 HydrophobicContact CD1-CZ3 4.19Å; L608-W611 PolarHBondContact O-N 2.7Å; S609-W611 VanDerWaalsContact C-N 3.28Å; S609-W611 PolarHBondContact O-N 3.41Å; W611-I613 VanDerWaalsContact C-N 3.33Å; W611-I613 PolarHBondContact O-N 2.86Å; W611-E614 PolarHBondContact O-N 3.49Å; W611-E614 VanDerWaalsContact O-N 3.14Å; W611-V615 HydrophobicContact CD2-CG2 3.83Å; W611-V615 HydrophobicContact CE3-CG2 3.95Å; W611-V615 HydrophobicContact CH2-CG2 3.73Å; W611-V615 HydrophobicContact CZ2-CG2 3.6Å; W611-V615 HydrophobicContact CZ3-CG2 3.91Å; W611-V615 WeakPolarHBondContact O-CG2 3.29Å; W611-V615 PolarHBondContact O-N 3.2Å
612	L	90.3	Very high	80.8	Confident	2 Å²	2	42 Å²	42	1%	0.01	22%	0.219	C	C	.	.	H	α-helix	trans	-62.1	-37.5	177.5	-77.4	174.2	0	0	0	112.9	I528 L608 S609 E614 V615 D616 L646 V650 C657	I528-L612 HydrophobicContact CD1-CD2 3.99Å; I528-L612 HydrophobicContact CG2-CD2 4.16Å; L608-L612 HydrophobicContact CD1-CG 4.32Å; L608-L612 HydrophobicContact CG-CD1 4.06Å; L608-L612 HydrophobicContact CG-CG 4.26Å; L608-L612 WeakPolarHBondContact O-CB 3.49Å; L608-L612 WeakPolarHBondContact O-CG 3.4Å; L608-L612 PolarHBondContact O-N 3.35Å; S609-L612 PolarHBondContact O-N 3.42Å; L612-E614 VanDerWaalsContact C-N 3.31Å; L612-E614 PolarHBondContact O-N 3.16Å; L612-V615 PolarHBondContact O-N 3.18Å; L612-D616 PolarHBondContact O-N 2.94Å; L612-L646 HydrophobicContact CD2-CD1 4.37Å; L612-V650 HydrophobicContact CD1-CG2 4.39Å; L612-V650 HydrophobicContact CD2-CG2 3.96Å; L612-C657 HydrophobicContact CD1-CB 3.76Å
613	I	87.9	Confident	82.7	Confident	82 Å²	82	35.4 Å²	35.4	42%	0.421	19%	0.191	S	C	.	.	H	α-helix	trans	-60.3	-44.1	174.5	-70	164.2	0	0	0	110.2	S609 W611 D616 K617 I660	S609-I613 VanDerWaalsContact O-CG1 3.29Å; S609-I613 WeakPolarHBondContact O-CG1 3.41Å; S609-I613 PolarHBondContact O-N 3.35Å; W611-I613 VanDerWaalsContact C-N 3.33Å; W611-I613 PolarHBondContact O-N 2.86Å; I613-D616 PolarHBondContact O-N 2.69Å; I613-K617 VanDerWaalsContact O-CB 3.27Å; I613-K617 WeakPolarHBondContact O-CB 3.37Å; I613-K617 PolarHBondContact O-N 2.57Å; I613-I660 HydrophobicContact CD1-CG2 3.68Å; I613-I660 HydrophobicContact CG1-CG2 3.54Å
614	E	88.1	Confident	84.2	Confident	22 Å²	22	39.8 Å²	39.8	10%	0.103	20%	0.202	C	C	.	.	H	α-helix	trans	-71.7	-31.4	179.7	-165.4	67.3	-154.7	0	0	112.1	R571 L575 R604 F605 D610 W611 L612 K617 F618	R571-E614 IonicContact CZ-OE1 2.88Å; R571-E614 IonicContact NE-OE1 2.9Å; R571-E614 PolarHBondContact NE-OE1 2.8Å; R571-E614 IonicContact NH2-OE1 2.89Å; R571-E614 PolarHBondContact NH2-OE1 3.29Å; L575-E614 HydrophobicContact CD2-CB 3.91Å; L575-E614 HydrophobicContact CD2-CG 3.78Å; R604-E614 IonicContact NH2-OE1 3.67Å; F605-E614 HydrophobicContact CE1-CB 3.83Å; F605-E614 HydrophobicContact CE1-CG 4.26Å; F605-E614 HydrophobicContact CZ-CB 3.84Å; F605-E614 HydrophobicContact CZ-CG 3.87Å; D610-E614 PolarHBondContact O-N 3.26Å; W611-E614 PolarHBondContact O-N 3.49Å; W611-E614 VanDerWaalsContact O-N 3.14Å; L612-E614 VanDerWaalsContact C-N 3.31Å; L612-E614 PolarHBondContact O-N 3.16Å; E614-K617 PolarHBondContact O-N 2.84Å; E614-K617 IonicContact OE1-NZ 2.69Å; E614-K617 IonicContact OE2-NZ 2.7Å; E614-F618 WeakPolarHBondContact O-CB 3.42Å; E614-F618 PolarHBondContact O-N 2.82Å
615	V	89.6	Confident	84.7	Confident	2 Å²	2	36.8 Å²	36.8	1%	0.012	19%	0.194	C	C	.	.	H	α-helix	trans	-65.7	-46	171.3	175.7	0	0	0	0	111.3	L532 L575 W611 L612 K617 F618 W619 L646	L532-V615 HydrophobicContact CD1-CG1 4.14Å; L575-V615 HydrophobicContact CD1-CG2 4.03Å; L575-V615 HydrophobicContact CD2-CG2 4.17Å; W611-V615 HydrophobicContact CD2-CG2 3.83Å; W611-V615 HydrophobicContact CE3-CG2 3.95Å; W611-V615 HydrophobicContact CH2-CG2 3.73Å; W611-V615 HydrophobicContact CZ2-CG2 3.6Å; W611-V615 HydrophobicContact CZ3-CG2 3.91Å; W611-V615 WeakPolarHBondContact O-CG2 3.29Å; W611-V615 PolarHBondContact O-N 3.2Å; L612-V615 PolarHBondContact O-N 3.18Å; V615-K617 VanDerWaalsContact C-N 3.32Å; V615-K617 PolarHBondContact O-N 3.44Å; V615-F618 WeakPolarHBondContact O-CB 3.48Å; V615-F618 PolarHBondContact O-N 2.74Å; V615-W619 PolarHBondContact O-N 2.85Å; V615-W619 VanDerWaalsContact O-N 3.11Å; V615-L646 HydrophobicContact CG1-CD1 4.16Å; V615-L646 HydrophobicContact CG1-CD2 4.02Å
616	D	89.4	Confident	84.2	Confident	19 Å²	19	41 Å²	41	10%	0.102	22%	0.221	C	C	.	.	H	α-helix	trans	-64.7	-38.6	175.3	-177.9	64.8	0	0	0	111.7	L612 I613 F618 W619 S620 R643 L646 L661	L612-D616 PolarHBondContact O-N 2.94Å; I613-D616 PolarHBondContact O-N 2.69Å; D616-F618 VanDerWaalsContact C-N 3.35Å; D616-W619 PolarHBondContact O-N 3.28Å; D616-S620 VanDerWaalsContact O-CB 3.28Å; D616-S620 WeakPolarHBondContact O-CB 3.33Å; D616-S620 PolarHBondContact O-N 3.19Å; D616-S620 PolarHBondContact O-OG 2.99Å; D616-R643 WeakPolarHBondContact OD1-CG 3.43Å; D616-R643 IonicContact OD1-CZ 3.57Å; D616-R643 IonicContact OD1-NE 2.8Å; D616-R643 PolarHBondContact OD1-NE 2.92Å; D616-R643 IonicContact OD1-NH2 3.27Å; D616-R643 PolarHBondContact OD1-NH2 3.04Å; D616-R643 IonicContact OD2-CZ 2.81Å; D616-R643 IonicContact OD2-NE 2.89Å; D616-R643 IonicContact OD2-NH2 3.85Å; D616-R643 PolarHBondContact OD2-NH2 3.04Å; D616-L646 HydrophobicContact CB-CD2 3.85Å; D616-L661 HydrophobicContact CB-CD2 3.57Å
617	K	88.6	Confident	83.4	Confident	95 Å²	95	42 Å²	42	41%	0.413	22%	0.222	S	C	.	.	H	α-helix	trans	-62.5	-42.2	174	-170.7	-175	168.8	-168.6	0	111.3	I613 E614 V615 S620 D621	I613-K617 VanDerWaalsContact O-CB 3.27Å; I613-K617 WeakPolarHBondContact O-CB 3.37Å; I613-K617 PolarHBondContact O-N 2.57Å; E614-K617 PolarHBondContact O-N 2.84Å; E614-K617 IonicContact OE1-NZ 2.69Å; E614-K617 IonicContact OE2-NZ 2.7Å; V615-K617 VanDerWaalsContact C-N 3.32Å; V615-K617 PolarHBondContact O-N 3.44Å; K617-S620 WeakPolarHBondContact O-CB 3.45Å; K617-S620 PolarHBondContact O-N 3.47Å; K617-D621 WeakPolarHBondContact O-CB 3.29Å; K617-D621 PolarHBondContact O-N 3.17Å
618	F	90	Very high	82	Confident	1 Å²	1	41.4 Å²	41.4	0%	0.004	22%	0.216	C	C	.	.	H	α-helix	trans	-55.9	-52.7	174.4	168.3	-94.6	0	0	0	111.6	F541 L568 R571 L572 L575 E614 V615 D616 S620 D621 A622	F541-F618 HydrophobicContact CD1-CZ 4.25Å; L568-F618 HydrophobicContact CB-CE2 3.91Å; L568-F618 HydrophobicContact CB-CZ 4.36Å; L568-F618 HydrophobicContact CD2-CD2 4.25Å; L568-F618 HydrophobicContact CD2-CE2 3.85Å; L568-F618 HydrophobicContact CG-CE2 4.4Å; L568-F618 VanDerWaalsContact O-CE2 3.23Å; L568-F618 WeakPolarHBondContact O-CE2 3.36Å; R571-F618 HydrophobicContact CB-CD2 4.2Å; R571-F618 HydrophobicContact CB-CE2 4.45Å; R571-F618 HydrophobicContact CG-CD2 4.07Å; L572-F618 HydrophobicContact CB-CE1 4.28Å; L572-F618 HydrophobicContact CB-CE2 3.93Å; L572-F618 HydrophobicContact CB-CZ 3.74Å; L572-F618 HydrophobicContact CD1-CD1 4.25Å; L572-F618 HydrophobicContact CD1-CE1 3.91Å; L572-F618 HydrophobicContact CD1-CZ 4.25Å; L572-F618 HydrophobicContact CD2-CE1 4.33Å; L572-F618 HydrophobicContact CD2-CZ 4.2Å; L572-F618 HydrophobicContact CG-CE1 4.4Å; L572-F618 HydrophobicContact CG-CZ 4.29Å; L575-F618 HydrophobicContact CD1-CB 3.89Å; L575-F618 HydrophobicContact CD1-CG 4.23Å; E614-F618 WeakPolarHBondContact O-CB 3.42Å; E614-F618 PolarHBondContact O-N 2.82Å; V615-F618 WeakPolarHBondContact O-CB 3.48Å; V615-F618 PolarHBondContact O-N 2.74Å; D616-F618 VanDerWaalsContact C-N 3.35Å; F618-S620 VanDerWaalsContact C-N 3.31Å; F618-S620 PolarHBondContact O-N 2.83Å; F618-D621 PolarHBondContact O-N 3.27Å; F618-A622 WeakPolarHBondContact O-CB 3.27Å; F618-A622 PolarHBondContact O-N 3.48Å
619	W	88.6	Confident	79.9	Confident	0 Å²	0	45.8 Å²	45.8	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-67.7	-31.6	179.4	-66.5	114	0	0	0	112.8	F541 V615 D616 A623 A639 L642 R643	F541-W619 HydrophobicContact CB-CH2 4.34Å; F541-W619 HydrophobicContact CD1-CZ3 4.22Å; F541-W619 AromaticContact CD2-CH2 3.87Å; F541-W619 HydrophobicContact CD2-CH2 3.87Å; F541-W619 AromaticContact CD2-CZ3 3.58Å; F541-W619 HydrophobicContact CD2-CZ3 3.58Å; F541-W619 HydrophobicContact CE1-CZ3 4.28Å; F541-W619 HydrophobicContact CE2-CH2 4.4Å; F541-W619 AromaticContact CE2-CZ3 3.67Å; F541-W619 HydrophobicContact CE2-CZ3 3.67Å; F541-W619 HydrophobicContact CG-CH2 4.04Å; F541-W619 AromaticContact CG-CZ3 3.88Å; F541-W619 HydrophobicContact CG-CZ3 3.88Å; F541-W619 HydrophobicContact CZ-CZ3 4.03Å; V615-W619 PolarHBondContact O-N 2.85Å; V615-W619 VanDerWaalsContact O-N 3.11Å; D616-W619 PolarHBondContact O-N 3.28Å; W619-A623 VanDerWaalsContact O-CB 3.22Å; W619-A623 WeakPolarHBondContact O-CB 3.44Å; W619-A623 PolarHBondContact O-N 3Å; W619-A639 HydrophobicContact CE3-CB 4.25Å; W619-L642 HydrophobicContact CD2-CB 4.1Å; W619-L642 HydrophobicContact CE3-CB 3.87Å; W619-L642 HydrophobicContact CE3-CD1 4.16Å; W619-L642 HydrophobicContact CH2-CB 4.17Å; W619-L642 HydrophobicContact CH2-CD1 3.44Å; W619-L642 VanDerWaalsContact CH2-CD1 3.44Å; W619-L642 HydrophobicContact CH2-CG 4.33Å; W619-L642 HydrophobicContact CZ2-CB 4.35Å; W619-L642 HydrophobicContact CZ2-CD1 4.29Å; W619-L642 HydrophobicContact CZ3-CB 3.92Å; W619-L642 HydrophobicContact CZ3-CD1 3.36Å; W619-L642 HydrophobicContact CZ3-CG 4.26Å; W619-R643 HydrophobicContact CB-CB 3.87Å; W619-R643 HydrophobicContact CB-CG 4.1Å
620	S	86.4	Confident	78	Confident	11 Å²	11	47.3 Å²	47.3	8%	0.077	27%	0.266	C	S	.	.	H	α-helix	trans	-63.1	-43.2	172.9	-63.9	0	0	0	0	112.8	D616 K617 F618 K624 R643	D616-S620 VanDerWaalsContact O-CB 3.28Å; D616-S620 WeakPolarHBondContact O-CB 3.33Å; D616-S620 PolarHBondContact O-N 3.19Å; D616-S620 PolarHBondContact O-OG 2.99Å; K617-S620 WeakPolarHBondContact O-CB 3.45Å; K617-S620 PolarHBondContact O-N 3.47Å; F618-S620 VanDerWaalsContact C-N 3.31Å; F618-S620 PolarHBondContact O-N 2.83Å; S620-K624 WeakPolarHBondContact O-CG 3.34Å; S620-R643 PolarHBondContact OG-NE 3.33Å; S620-R643 VanDerWaalsContact OG-NE 3.1Å; S620-R643 PolarHBondContact OG-NH1 2.87Å; S620-R643 PolarHBondContact OG-NH2 3.5Å
621	D	85.8	Confident	76.1	Confident	48 Å²	48	46.3 Å²	46.3	26%	0.257	26%	0.263	S	S	.	.	H	α-helix	trans	-71.9	-46	179.2	-64.7	-21	0	0	0	109.4	R571 K617 F618 A623 K624 E625	R571-D621 IonicContact CZ-OD2 2.76Å; R571-D621 IonicContact NH1-OD2 3.55Å; R571-D621 PolarHBondContact NH1-OD2 3.06Å; R571-D621 IonicContact NH2-OD2 2.8Å; R571-D621 PolarHBondContact NH2-OD2 3.03Å; K617-D621 WeakPolarHBondContact O-CB 3.29Å; K617-D621 PolarHBondContact O-N 3.17Å; F618-D621 PolarHBondContact O-N 3.27Å; D621-A623 PolarHBondContact O-N 3.4Å; D621-K624 PolarHBondContact O-N 3.31Å; D621-E625 WeakPolarHBondContact O-CB 3.48Å; D621-E625 PolarHBondContact O-N 3.39Å
622	A	84	Confident	74.4	Confident	3 Å²	3	50 Å²	50	3%	0.025	29%	0.286	C	S	.	.	H	α-helix	trans	-57.5	-33	175.2	0	0	0	0	0	113.2	F541 L568 F618 K624 L636 A639	F541-A622 HydrophobicContact CE1-CB 4.08Å; F541-A622 HydrophobicContact CZ-CB 4.47Å; L568-A622 HydrophobicContact CD1-CB 3.78Å; L568-A622 HydrophobicContact CD2-CB 4.48Å; F618-A622 WeakPolarHBondContact O-CB 3.27Å; F618-A622 PolarHBondContact O-N 3.48Å; A622-K624 VanDerWaalsContact C-N 3.28Å; A622-K624 PolarHBondContact O-N 3.01Å; A622-L636 WeakPolarHBondContact O-CD2 3.46Å; A622-A639 HydrophobicContact CB-CB 3.79Å
623	A	84.2	Confident	72.8	Confident	16 Å²	16	57.9 Å²	57.9	13%	0.132	32%	0.32	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.8	-9.5	176	0	0	0	0	0	114.6	W619 D621 A639 Q640	W619-A623 VanDerWaalsContact O-CB 3.22Å; W619-A623 WeakPolarHBondContact O-CB 3.44Å; W619-A623 PolarHBondContact O-N 3Å; D621-A623 PolarHBondContact O-N 3.4Å; A623-A639 HydrophobicContact CB-CB 4.01Å; A623-Q640 HydrophobicContact CB-CG 3.71Å
624	K	80.3	Confident	71.6	Confident	155 Å²	155	55.2 Å²	55.2	67%	0.674	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-115.1	-15.8	179.7	-66	172.1	-173.4	171.5	0	113.1	S620 D621 A622 T626	S620-K624 WeakPolarHBondContact O-CG 3.34Å; D621-K624 PolarHBondContact O-N 3.31Å; A622-K624 VanDerWaalsContact C-N 3.28Å; A622-K624 PolarHBondContact O-N 3.01Å; K624-T626 PolarHBondContact O-N 2.93Å
625	E	72.2	Confident	70.7	Confident	54 Å²	54	54.9 Å²	54.9	25%	0.252	31%	0.313	S	S	.	.			trans	-75.2	122	-169.6	-163.3	60.4	-135.1	0	0	112.9	D621 I628 L636	D621-E625 WeakPolarHBondContact O-CB 3.48Å; D621-E625 PolarHBondContact O-N 3.39Å; E625-I628 HydrophobicContact CB-CD1 4.12Å; E625-I628 HydrophobicContact CG-CD1 3.85Å; E625-I628 HydrophobicContact CG-CG1 3.79Å; E625-L636 VanDerWaalsContact O-CD2 3.31Å; E625-L636 WeakPolarHBondContact O-CD2 3.23Å
626	T	63.4	Low	69.9	Low	106 Å²	106	56.7 Å²	56.7	65%	0.65	32%	0.323	S	S	*	.			trans	-102.1	-14.1	-179.1	50.2	0	0	0	0	113.9	K624	K624-T626 PolarHBondContact O-N 2.93Å
627	N	54.9	Low	69.3	Low	130 Å²	130	59.7 Å²	59.7	70%	0.695	34%	0.336	S	S	*	.			trans	-108.5	55.3	-167.9	-74	-32.4	0	0	0	114.2
628	I	51.9	Low	68.8	Low	32 Å²	32	55.3 Å²	55.3	16%	0.164	32%	0.317	C	S	.	.			trans	-119.8	139.6	178.5	-47.3	167.5	0	0	0	110.3	L568 E625 G630 S631	L568-I628 HydrophobicContact CD1-CD1 3.39Å; L568-I628 HydrophobicContact CG-CD1 4.21Å; E625-I628 HydrophobicContact CB-CD1 4.12Å; E625-I628 HydrophobicContact CG-CD1 3.85Å; E625-I628 HydrophobicContact CG-CG1 3.79Å; I628-G630 PolarHBondContact O-N 2.89Å; I628-S631 PolarHBondContact O-N 2.79Å; I628-S631 VanDerWaalsContact O-N 3.14Å
629	C	41.8	Very low	68.6	Low	96 Å²	96	55.2 Å²	55.2	65%	0.649	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.3	105.8	167.8	-173.8	0	0	0	0	109.7
630	G	44.3	Very low	68.5	Low	62 Å²	62	60.2 Å²	60.2	64%	0.639	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	91.9	5.3	-179.8	0	0	0	0	0	116.3	I628 T632	I628-G630 PolarHBondContact O-N 2.89Å; G630-T632 PolarHBondContact O-N 3.37Å
631	S	47	Very low	68.5	Low	35 Å²	35	66.3 Å²	66.3	25%	0.245	36%	0.362	C	S	.	.			trans	-68.8	108.3	171.8	178.2	0	0	0	0	110.3	I628	I628-S631 PolarHBondContact O-N 2.79Å; I628-S631 VanDerWaalsContact O-N 3.14Å
632	T	53.3	Low	68.6	Low	80 Å²	80	64 Å²	64	49%	0.491	35%	0.35	S	S	.	.			trans	-90.9	166.2	169.7	64.1	0	0	0	0	109.3	G630 G634 C635	G630-T632 PolarHBondContact O-N 3.37Å; T632-G634 PolarHBondContact O-N 2.96Å; T632-G634 PolarHBondContact OG1-N 3.27Å; T632-C635 PolarHBondContact O-N 3.44Å; T632-C635 PolarHBondContact OG1-N 3.19Å
633	K	57.5	Low	68.9	Low	166 Å²	166	67.9 Å²	67.9	72%	0.722	36%	0.363	S	S	*	.	H	α-helix	trans	-50.5	-26.8	166.6	-170.8	179.8	177.6	-175	0	112.1	Q637	K633-Q637 WeakPolarHBondContact O-CG 3.27Å; K633-Q637 PolarHBondContact O-N 3.3Å
634	G	62.8	Low	69	Low	27 Å²	27	71 Å²	71	28%	0.278	39%	0.385	S	S	.	.	H	α-helix	trans	-65.9	-41.9	173.1	0	0	0	0	0	113.8	T632 L636 Q637 A638	T632-G634 PolarHBondContact O-N 2.96Å; T632-G634 PolarHBondContact OG1-N 3.27Å; G634-L636 VanDerWaalsContact C-N 3.34Å; G634-L636 PolarHBondContact O-N 2.91Å; G634-Q637 PolarHBondContact O-N 3.09Å; G634-A638 VanDerWaalsContact O-CB 3.29Å; G634-A638 WeakPolarHBondContact O-CB 3.46Å; G634-A638 PolarHBondContact O-N 2.95Å
635	C	68.8	Low	69.5	Low	14 Å²	14	66.3 Å²	66.3	10%	0.095	37%	0.365	C	S	.	.	H	α-helix	trans	-62.6	-40	178.9	-58.9	0	0	0	0	112.4	T632 A638 A639	T632-C635 PolarHBondContact O-N 3.44Å; T632-C635 PolarHBondContact OG1-N 3.19Å; C635-A638 PolarHBondContact O-N 3.44Å; C635-A639 PolarHBondContact O-N 2.81Å
636	L	73.8	Confident	70.4	Confident	41 Å²	41	63.8 Å²	63.8	22%	0.215	35%	0.353	C	S	.	.	H	α-helix	trans	-64.5	-44.2	175.7	-70.7	175.7	0	0	0	111.9	A622 E625 G634 A639 Q640	A622-L636 WeakPolarHBondContact O-CD2 3.46Å; E625-L636 VanDerWaalsContact O-CD2 3.31Å; E625-L636 WeakPolarHBondContact O-CD2 3.23Å; G634-L636 VanDerWaalsContact C-N 3.34Å; G634-L636 PolarHBondContact O-N 2.91Å; L636-A639 PolarHBondContact O-N 3.26Å; L636-Q640 WeakPolarHBondContact O-CG 3.33Å; L636-Q640 PolarHBondContact O-N 2.99Å; L636-Q640 VanDerWaalsContact O-N 3.09Å
637	Q	76.3	Confident	71.6	Confident	82 Å²	82	61.1 Å²	61.1	38%	0.383	34%	0.335	S	S	.	.	H	α-helix	trans	-66.2	-39.5	177.2	-72.2	179.1	-22.1	0	0	111.6	K633 G634 Q640 R641	K633-Q637 WeakPolarHBondContact O-CG 3.27Å; K633-Q637 PolarHBondContact O-N 3.3Å; G634-Q637 PolarHBondContact O-N 3.09Å; Q637-Q640 PolarHBondContact O-N 3.31Å; Q637-R641 WeakPolarHBondContact O-CG 3.15Å; Q637-R641 PolarHBondContact O-N 3.22Å
638	A	78.3	Confident	73.2	Confident	2 Å²	2	57.6 Å²	57.6	2%	0.017	32%	0.321	C	S	.	.	H	α-helix	trans	-59.1	-48.7	173.8	0	0	0	0	0	111.7	E537 F541 G634 C635 Q640 R641 L642	E537-A638 HydrophobicContact CB-CB 3.79Å; E537-A638 WeakPolarHBondContact OE2-CA 3.32Å; F541-A638 HydrophobicContact CE2-CB 4.2Å; G634-A638 VanDerWaalsContact O-CB 3.29Å; G634-A638 WeakPolarHBondContact O-CB 3.46Å; G634-A638 PolarHBondContact O-N 2.95Å; C635-A638 PolarHBondContact O-N 3.44Å; A638-Q640 VanDerWaalsContact C-N 3.32Å; A638-Q640 PolarHBondContact O-N 3.25Å; A638-R641 PolarHBondContact O-N 3.4Å; A638-L642 WeakPolarHBondContact O-CB 3.41Å; A638-L642 WeakPolarHBondContact O-CG 3.02Å; A638-L642 PolarHBondContact O-N 3.34Å
639	A	85.4	Confident	74.9	Confident	0 Å²	0	56.5 Å²	56.5	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-60.2	-40.1	176	0	0	0	0	0	112.6	F541 W619 A622 A623 C635 L636 R643	F541-A639 HydrophobicContact CZ-CB 3.93Å; W619-A639 HydrophobicContact CE3-CB 4.25Å; A622-A639 HydrophobicContact CB-CB 3.79Å; A623-A639 HydrophobicContact CB-CB 4.01Å; C635-A639 PolarHBondContact O-N 2.81Å; L636-A639 PolarHBondContact O-N 3.26Å; A639-R643 WeakPolarHBondContact O-CB 3.29Å; A639-R643 PolarHBondContact O-N 3.15Å
640	Q	85.4	Confident	77.2	Confident	105 Å²	105	52 Å²	52	49%	0.491	28%	0.284	S	S	.	.	H	α-helix	trans	-62.7	-45	176.7	-72.3	173.3	-1.7	0	0	112.1	A623 L636 Q637 A638 R643 S644	A623-Q640 HydrophobicContact CB-CG 3.71Å; L636-Q640 WeakPolarHBondContact O-CG 3.33Å; L636-Q640 PolarHBondContact O-N 2.99Å; L636-Q640 VanDerWaalsContact O-N 3.09Å; Q637-Q640 PolarHBondContact O-N 3.31Å; A638-Q640 VanDerWaalsContact C-N 3.32Å; A638-Q640 PolarHBondContact O-N 3.25Å; Q640-R643 WeakPolarHBondContact O-CB 3.49Å; Q640-R643 PolarHBondContact O-N 2.84Å; Q640-S644 PolarHBondContact O-N 3.41Å; Q640-S644 PolarHBondContact O-OG 3.31Å
641	R	86.2	Confident	79.2	Confident	139 Å²	139	55.2 Å²	55.2	53%	0.525	28%	0.277	S	S	.	.	H	α-helix	trans	-68.7	-41.8	178.8	-74.5	172.5	176.8	167.3	-0.1	112	E537 Q637 A638 R643 S644 H645	E537-R641 VanDerWaalsContact CD-CD 3.4Å; E537-R641 WeakPolarHBondContact OE1-CD 3.43Å; E537-R641 IonicContact OE1-CZ 2.93Å; E537-R641 IonicContact OE1-NE 2.88Å; E537-R641 IonicContact OE1-NH1 2.62Å; E537-R641 PolarHBondContact OE1-NH1 2.69Å; E537-R641 WeakPolarHBondContact OE2-CB 3.27Å; E537-R641 WeakPolarHBondContact OE2-CD 3.4Å; Q637-R641 WeakPolarHBondContact O-CG 3.15Å; Q637-R641 PolarHBondContact O-N 3.22Å; A638-R641 PolarHBondContact O-N 3.4Å; R641-R643 VanDerWaalsContact C-N 3.3Å; R641-R643 PolarHBondContact O-N 2.89Å; R641-S644 CarbonylContact O-C 3.44Å; R641-S644 WeakPolarHBondContact O-CB 3.41Å; R641-S644 PolarHBondContact O-N 3.3Å; R641-S644 VanDerWaalsContact O-N 3.13Å; R641-H645 WeakPolarHBondContact O-CB 3.27Å; R641-H645 PolarHBondContact O-N 3.19Å
642	L	88.6	Confident	81	Confident	0 Å²	0	59.9 Å²	59.9	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-63	-36.2	174.3	-69.9	167.4	0	0	0	111.7	L532 H535 A538 F541 W619 A638 H645 L646	L532-L642 HydrophobicContact CD2-CB 4.48Å; L532-L642 HydrophobicContact CD2-CD2 4.5Å; L532-L642 VanDerWaalsContact CD2-O 3.27Å; L532-L642 WeakPolarHBondContact CD2-O 3.17Å; H535-L642 HydrophobicContact CB-CD2 3.64Å; A538-L642 HydrophobicContact CB-CD1 4.29Å; A538-L642 HydrophobicContact CB-CD2 4.33Å; F541-L642 HydrophobicContact CD2-CD1 3.98Å; F541-L642 HydrophobicContact CE2-CD1 3.98Å; W619-L642 HydrophobicContact CD2-CB 4.1Å; W619-L642 HydrophobicContact CE3-CB 3.87Å; W619-L642 HydrophobicContact CE3-CD1 4.16Å; W619-L642 HydrophobicContact CH2-CB 4.17Å; W619-L642 HydrophobicContact CH2-CD1 3.44Å; W619-L642 VanDerWaalsContact CH2-CD1 3.44Å; W619-L642 HydrophobicContact CH2-CG 4.33Å; W619-L642 HydrophobicContact CZ2-CB 4.35Å; W619-L642 HydrophobicContact CZ2-CD1 4.29Å; W619-L642 HydrophobicContact CZ3-CB 3.92Å; W619-L642 HydrophobicContact CZ3-CD1 3.36Å; W619-L642 HydrophobicContact CZ3-CG 4.26Å; A638-L642 WeakPolarHBondContact O-CB 3.41Å; A638-L642 WeakPolarHBondContact O-CG 3.02Å; A638-L642 PolarHBondContact O-N 3.34Å; L642-H645 CarbonylContact O-C 3.5Å; L642-H645 PolarHBondContact O-N 3.31Å; L642-L646 PolarHBondContact O-N 3.2Å
643	R	90.6	Very high	82.5	Confident	83 Å²	83	58 Å²	58	31%	0.313	28%	0.281	S	S	.	.	H	α-helix	trans	-64.9	-42.6	171	-165.9	-178.1	177.8	-164.5	2.7	112.5	D616 W619 S620 A639 Q640 R641 H645 L646 N647	D616-R643 WeakPolarHBondContact OD1-CG 3.43Å; D616-R643 IonicContact OD1-CZ 3.57Å; D616-R643 IonicContact OD1-NE 2.8Å; D616-R643 PolarHBondContact OD1-NE 2.92Å; D616-R643 IonicContact OD1-NH2 3.27Å; D616-R643 PolarHBondContact OD1-NH2 3.04Å; D616-R643 IonicContact OD2-CZ 2.81Å; D616-R643 IonicContact OD2-NE 2.89Å; D616-R643 IonicContact OD2-NH2 3.85Å; D616-R643 PolarHBondContact OD2-NH2 3.04Å; W619-R643 HydrophobicContact CB-CB 3.87Å; W619-R643 HydrophobicContact CB-CG 4.1Å; S620-R643 PolarHBondContact OG-NE 3.33Å; S620-R643 VanDerWaalsContact OG-NE 3.1Å; S620-R643 PolarHBondContact OG-NH1 2.87Å; S620-R643 PolarHBondContact OG-NH2 3.5Å; A639-R643 WeakPolarHBondContact O-CB 3.29Å; A639-R643 PolarHBondContact O-N 3.15Å; Q640-R643 WeakPolarHBondContact O-CB 3.49Å; Q640-R643 PolarHBondContact O-N 2.84Å; R641-R643 VanDerWaalsContact C-N 3.3Å; R641-R643 PolarHBondContact O-N 2.89Å; R643-H645 VanDerWaalsContact C-N 3.27Å; R643-H645 PolarHBondContact O-N 2.83Å; R643-L646 WeakPolarHBondContact O-CB 3.37Å; R643-L646 PolarHBondContact O-N 3.23Å; R643-N647 PolarHBondContact O-N 2.8Å; R643-N647 PolarHBondContact O-ND2 3.23Å
644	S	86.5	Confident	83.8	Confident	83 Å²	83	52.8 Å²	52.8	58%	0.58	26%	0.257	S	S	*	.	H	α-helix	trans	-62.1	-38.4	172.7	-63.8	0	0	0	0	111.5	Q640 R641 N647 S648	Q640-S644 PolarHBondContact O-N 3.41Å; Q640-S644 PolarHBondContact O-OG 3.31Å; R641-S644 CarbonylContact O-C 3.44Å; R641-S644 WeakPolarHBondContact O-CB 3.41Å; R641-S644 PolarHBondContact O-N 3.3Å; R641-S644 VanDerWaalsContact O-N 3.13Å; S644-N647 PolarHBondContact O-N 3.22Å; S644-S648 PolarHBondContact O-N 3.39Å
645	H	90.2	Very high	84.8	Confident	56 Å²	56	55.1 Å²	55.1	26%	0.259	27%	0.267	S	S	.	.	H	α-helix	trans	-67.9	-38.1	177	-167.2	51.9	0	0	0	112.4	L532 R641 L642 R643 N647 S648 L649	L532-H645 HydrophobicContact CD2-CB 4.46Å; R641-H645 WeakPolarHBondContact O-CB 3.27Å; R641-H645 PolarHBondContact O-N 3.19Å; L642-H645 CarbonylContact O-C 3.5Å; L642-H645 PolarHBondContact O-N 3.31Å; R643-H645 VanDerWaalsContact C-N 3.27Å; R643-H645 PolarHBondContact O-N 2.83Å; H645-N647 VanDerWaalsContact C-N 3.29Å; H645-N647 PolarHBondContact O-N 2.72Å; H645-S648 WeakPolarHBondContact O-CA 3.35Å; H645-S648 VanDerWaalsContact O-CB 3.28Å; H645-S648 WeakPolarHBondContact O-CB 3.4Å; H645-S648 PolarHBondContact O-N 3.5Å; H645-L649 WeakPolarHBondContact O-CG 3.32Å; H645-L649 PolarHBondContact O-N 3.24Å
646	L	91	Very high	85.4	Confident	0 Å²	0	58.9 Å²	58.9	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-53.5	-46.3	172.2	172.1	63.9	0	0	0	111.3	I528 L532 L612 V615 D616 L642 R643 S648 L649 V650 L661	I528-L646 HydrophobicContact CG2-CD1 3.59Å; L532-L646 HydrophobicContact CD1-CB 4.41Å; L532-L646 HydrophobicContact CD1-CD1 4Å; L532-L646 HydrophobicContact CD2-CB 4.01Å; L612-L646 HydrophobicContact CD2-CD1 4.37Å; V615-L646 HydrophobicContact CG1-CD1 4.16Å; V615-L646 HydrophobicContact CG1-CD2 4.02Å; D616-L646 HydrophobicContact CB-CD2 3.85Å; L642-L646 PolarHBondContact O-N 3.2Å; R643-L646 WeakPolarHBondContact O-CB 3.37Å; R643-L646 PolarHBondContact O-N 3.23Å; L646-S648 PolarHBondContact O-N 2.79Å; L646-L649 PolarHBondContact O-N 3.02Å; L646-V650 HydrophobicContact CD1-CG2 3.8Å; L646-V650 HydrophobicContact CG-CG2 4.33Å; L646-V650 WeakPolarHBondContact O-CB 3.41Å; L646-V650 VanDerWaalsContact O-CG2 3.25Å; L646-V650 WeakPolarHBondContact O-CG2 3.46Å; L646-V650 PolarHBondContact O-N 2.97Å; L646-L661 HydrophobicContact CD2-CD1 4.36Å; L646-L661 HydrophobicContact CG-CD1 4.16Å
647	N	88.7	Confident	85.7	Confident	50 Å²	50	57.2 Å²	57.2	27%	0.267	28%	0.278	S	S	.	.	H	α-helix	trans	-62.2	-32.4	177.2	-71.8	-62.2	0	0	0	112.6	R643 S644 H645 R651	R643-N647 PolarHBondContact O-N 2.8Å; R643-N647 PolarHBondContact O-ND2 3.23Å; S644-N647 PolarHBondContact O-N 3.22Å; H645-N647 VanDerWaalsContact C-N 3.29Å; H645-N647 PolarHBondContact O-N 2.72Å; N647-R651 WeakPolarHBondContact O-CB 3.48Å; N647-R651 PolarHBondContact O-N 3.27Å
648	S	87.6	Confident	85.9	Confident	57 Å²	57	56.1 Å²	56.1	40%	0.399	27%	0.273	S	S	.	.	H	α-helix	trans	-70.4	-47	174	-166.8	0	0	0	0	111.6	S644 H645 L646 V650 R651 E652	S644-S648 PolarHBondContact O-N 3.39Å; H645-S648 WeakPolarHBondContact O-CA 3.35Å; H645-S648 VanDerWaalsContact O-CB 3.28Å; H645-S648 WeakPolarHBondContact O-CB 3.4Å; H645-S648 PolarHBondContact O-N 3.5Å; L646-S648 PolarHBondContact O-N 2.79Å; S648-V650 VanDerWaalsContact C-N 3.34Å; S648-V650 PolarHBondContact O-N 3.13Å; S648-R651 WeakPolarHBondContact O-CB 3.46Å; S648-R651 PolarHBondContact O-N 2.95Å; S648-E652 PolarHBondContact O-N 3.03Å
649	L	89	Confident	85.9	Confident	9 Å²	9	60.2 Å²	60.2	5%	0.047	29%	0.294	C	S	.	.	H	α-helix	trans	-64	-38.4	180	-69.9	169.5	0	0	0	112.2	I528 L532 H645 L646 E652 H653	I528-L649 HydrophobicContact CG1-CB 4.4Å; I528-L649 HydrophobicContact CG2-CB 4.48Å; L532-L649 HydrophobicContact CD2-CD1 4.03Å; L532-L649 HydrophobicContact CG-CD1 3.8Å; H645-L649 WeakPolarHBondContact O-CG 3.32Å; H645-L649 PolarHBondContact O-N 3.24Å; L646-L649 PolarHBondContact O-N 3.02Å; L649-E652 PolarHBondContact O-N 3.37Å; L649-H653 WeakPolarHBondContact O-CB 3.37Å; L649-H653 PolarHBondContact O-N 3.48Å
650	V	88.7	Confident	85.5	Confident	1 Å²	1	63.5 Å²	63.5	1%	0.006	31%	0.311	C	S	.	.	H	α-helix	trans	-67.2	-41.9	176.5	171.3	0	0	0	0	110.7	I528 L612 L646 S648 E652 R654 C657 L661	I528-V650 HydrophobicContact CD1-CG2 4.02Å; I528-V650 HydrophobicContact CG2-CG2 4.49Å; L612-V650 HydrophobicContact CD1-CG2 4.39Å; L612-V650 HydrophobicContact CD2-CG2 3.96Å; L646-V650 HydrophobicContact CD1-CG2 3.8Å; L646-V650 HydrophobicContact CG-CG2 4.33Å; L646-V650 WeakPolarHBondContact O-CB 3.41Å; L646-V650 VanDerWaalsContact O-CG2 3.25Å; L646-V650 WeakPolarHBondContact O-CG2 3.46Å; L646-V650 PolarHBondContact O-N 2.97Å; S648-V650 VanDerWaalsContact C-N 3.34Å; S648-V650 PolarHBondContact O-N 3.13Å; V650-E652 PolarHBondContact O-N 3.1Å; V650-R654 CarbonylContact O-C 3.56Å; V650-R654 VanDerWaalsContact O-CA 3.31Å; V650-R654 WeakPolarHBondContact O-CA 3.48Å; V650-R654 PolarHBondContact O-N 3.48Å; V650-C657 HydrophobicContact CG1-CB 4.05Å; V650-L661 HydrophobicContact CB-CD1 4.08Å; V650-L661 HydrophobicContact CG1-CD1 4.1Å; V650-L661 HydrophobicContact CG2-CD1 3.74Å
651	R	87	Confident	85	Confident	130 Å²	130	59.4 Å²	59.4	49%	0.491	29%	0.292	S	S	.	.	H	α-helix	trans	-58.4	-38.5	173.3	-174.4	-165.2	-50.2	-67.6	-19.5	112.2	N647 S648 E658	N647-R651 WeakPolarHBondContact O-CB 3.48Å; N647-R651 PolarHBondContact O-N 3.27Å; S648-R651 WeakPolarHBondContact O-CB 3.46Å; S648-R651 PolarHBondContact O-N 2.95Å; R651-E658 IonicContact CZ-OE1 3.89Å; R651-E658 IonicContact CZ-OE2 2.89Å; R651-E658 VanDerWaalsContact NH1-CD 3.29Å; R651-E658 IonicContact NH1-OE1 3.69Å; R651-E658 PolarHBondContact NH1-OE1 3.44Å; R651-E658 IonicContact NH1-OE2 3.89Å; R651-E658 PolarHBondContact NH1-OE2 3.13Å; R651-E658 IonicContact NH2-OE1 3.45Å; R651-E658 PolarHBondContact NH2-OE1 2.78Å
652	E	85.4	Confident	84	Confident	133 Å²	133	55.9 Å²	55.9	62%	0.621	29%	0.289	S	S	*	.	H	α-helix	trans	-77.6	-46.6	-176.7	-169.2	-178.5	157.1	0	0	112.8	S648 L649 V650	S648-E652 PolarHBondContact O-N 3.03Å; L649-E652 PolarHBondContact O-N 3.37Å; V650-E652 PolarHBondContact O-N 3.1Å
653	H	84.9	Confident	82.4	Confident	40 Å²	40	58.7 Å²	58.7	19%	0.185	32%	0.318	C	S	.	.	H	α-helix	trans	-101.5	-19.4	-170.3	-62.2	-12.8	0	0	0	114	R527 I528 L649	R527-H653 VanDerWaalsContact CB-CD2 3.42Å; R527-H653 WeakPolarHBondContact CB-CD2 3.48Å; I528-H653 HydrophobicContact CG1-CB 4.29Å; L649-H653 WeakPolarHBondContact O-CB 3.37Å; L649-H653 PolarHBondContact O-N 3.48Å
654	R	84.7	Confident	79.8	Confident	57 Å²	57	62 Å²	62	22%	0.215	34%	0.335	C	S	.	.			trans	-154.3	66.6	-179.9	-156.4	63.7	-173	-156.2	-12.6	113.1	S520 D521 L608 V650 D656 C657	S520-R654 PolarHBondContact OG-NH1 3.25Å; D521-R654 IonicContact OD1-CZ 3.1Å; D521-R654 IonicContact OD1-NE 2.65Å; D521-R654 IonicContact OD1-NH1 3.26Å; D521-R654 PolarHBondContact OD1-NH1 2.68Å; D521-R654 IonicContact OD1-NH2 2.89Å; D521-R654 PolarHBondContact OD1-NH2 3.27Å; L608-R654 HydrophobicContact CD2-CG 4.06Å; V650-R654 CarbonylContact O-C 3.56Å; V650-R654 VanDerWaalsContact O-CA 3.31Å; V650-R654 WeakPolarHBondContact O-CA 3.48Å; V650-R654 PolarHBondContact O-N 3.48Å; R654-D656 VanDerWaalsContact C-OD1 3.29Å; R654-D656 WeakPolarHBondContact CD-OD1 3.47Å; R654-D656 WeakPolarHBondContact CG-OD1 3.08Å; R654-D656 IonicContact CZ-OD2 3.97Å; R654-D656 VanDerWaalsContact NE-CG 3.28Å; R654-D656 IonicContact NE-OD1 3.44Å; R654-D656 PolarHBondContact NE-OD1 3.25Å; R654-D656 IonicContact NE-OD2 3.15Å; R654-D656 PolarHBondContact NE-OD2 3.49Å; R654-D656 IonicContact NH2-OD2 3.46Å; R654-D656 PolarHBondContact O-N 3.37Å; R654-D656 VanDerWaalsContact O-N 3.17Å; R654-C657 HydrophobicContact CG-CB 4.22Å; R654-C657 WeakPolarHBondContact O-CB 3.24Å; R654-C657 PolarHBondContact O-N 3.03Å
655	P	82.8	Confident	77.2	Confident	76 Å²	76	64 Å²	64	49%	0.494	34%	0.344	S	S	.	.	G	3₁₀ helix	trans	-62	-25	-172.9	23.9	-34.1	0	0	0	114.1	C657 E658	P655-C657 PolarHBondContact O-N 3.19Å; P655-E658 VanDerWaalsContact O-CB 3.27Å; P655-E658 WeakPolarHBondContact O-CB 3.44Å; P655-E658 PolarHBondContact O-N 3.35Å; P655-E658 VanDerWaalsContact O-N 3.08Å
656	D	82.2	Confident	74.2	Confident	92 Å²	92	68.7 Å²	68.7	49%	0.492	37%	0.369	S	S	.	.	G	3₁₀ helix	trans	-57.9	-29.6	171.8	52.2	-56.4	0	0	0	112.9	R654	R654-D656 VanDerWaalsContact C-OD1 3.29Å; R654-D656 WeakPolarHBondContact CD-OD1 3.47Å; R654-D656 WeakPolarHBondContact CG-OD1 3.08Å; R654-D656 IonicContact CZ-OD2 3.97Å; R654-D656 VanDerWaalsContact NE-CG 3.28Å; R654-D656 IonicContact NE-OD1 3.44Å; R654-D656 PolarHBondContact NE-OD1 3.25Å; R654-D656 IonicContact NE-OD2 3.15Å; R654-D656 PolarHBondContact NE-OD2 3.49Å; R654-D656 IonicContact NH2-OD2 3.46Å; R654-D656 PolarHBondContact O-N 3.37Å; R654-D656 VanDerWaalsContact O-N 3.17Å
657	C	80.8	Confident	71.2	Confident	7 Å²	7	72.2 Å²	72.2	5%	0.047	40%	0.398	C	S	.	.	G	3₁₀ helix	trans	-86.8	-3.3	177.6	-67.7	0	0	0	0	113.6	L612 V650 R654 P655 N659 I660	L612-C657 HydrophobicContact CD1-CB 3.76Å; V650-C657 HydrophobicContact CG1-CB 4.05Å; R654-C657 HydrophobicContact CG-CB 4.22Å; R654-C657 WeakPolarHBondContact O-CB 3.24Å; R654-C657 PolarHBondContact O-N 3.03Å; P655-C657 PolarHBondContact O-N 3.19Å; C657-N659 VanDerWaalsContact C-N 3.31Å; C657-N659 PolarHBondContact O-N 3.23Å; C657-I660 HydrophobicContact CB-CD1 4.17Å; C657-I660 VanDerWaalsContact O-CB 3.27Å; C657-I660 WeakPolarHBondContact O-CB 3.37Å; C657-I660 PolarHBondContact O-N 3.24Å; C657-I660 VanDerWaalsContact O-N 3.08Å
658	E	79.8	Confident	68.3	Low	59 Å²	59	76.9 Å²	76.9	28%	0.276	42%	0.423	S	S	.	.	H	α-helix	trans	-62	-37.3	-177.1	-174	-180	178.9	0	0	112.7	R651 P655 I660 L661 S662	R651-E658 IonicContact CZ-OE1 3.89Å; R651-E658 IonicContact CZ-OE2 2.89Å; R651-E658 VanDerWaalsContact NH1-CD 3.29Å; R651-E658 IonicContact NH1-OE1 3.69Å; R651-E658 PolarHBondContact NH1-OE1 3.44Å; R651-E658 IonicContact NH1-OE2 3.89Å; R651-E658 PolarHBondContact NH1-OE2 3.13Å; R651-E658 IonicContact NH2-OE1 3.45Å; R651-E658 PolarHBondContact NH2-OE1 2.78Å; P655-E658 VanDerWaalsContact O-CB 3.27Å; P655-E658 WeakPolarHBondContact O-CB 3.44Å; P655-E658 PolarHBondContact O-N 3.35Å; P655-E658 VanDerWaalsContact O-N 3.08Å; E658-I660 PolarHBondContact O-N 3.03Å; E658-L661 PolarHBondContact O-N 3.23Å; E658-S662 PolarHBondContact O-N 3.03Å; E658-S662 PolarHBondContact O-OG 3.31Å; E658-S662 VanDerWaalsContact O-OG 3.14Å
659	N	77.6	Confident	65.3	Low	87 Å²	87	81.6 Å²	81.6	47%	0.465	44%	0.443	S	S	.	.	H	α-helix	trans	-63.5	-24.8	178.5	-68.8	-35.2	0	0	0	112.5	C657 S662	C657-N659 VanDerWaalsContact C-N 3.31Å; C657-N659 PolarHBondContact O-N 3.23Å; N659-S662 WeakPolarHBondContact CA-OG 3.26Å; N659-S662 PolarHBondContact O-OG 2.77Å
660	I	77.2	Confident	62.3	Low	69 Å²	69	89.3 Å²	89.3	35%	0.354	48%	0.484	S	S	.	.	H	α-helix	trans	-73.6	-39.7	-177.2	-52.8	-179.1	0	0	0	110.3	I613 C657 E658	I613-I660 HydrophobicContact CD1-CG2 3.68Å; I613-I660 HydrophobicContact CG1-CG2 3.54Å; C657-I660 HydrophobicContact CB-CD1 4.17Å; C657-I660 VanDerWaalsContact O-CB 3.27Å; C657-I660 WeakPolarHBondContact O-CB 3.37Å; C657-I660 PolarHBondContact O-N 3.24Å; C657-I660 VanDerWaalsContact O-N 3.08Å; E658-I660 PolarHBondContact O-N 3.03Å
661	L	75.2	Confident	59.4	Low	20 Å²	20	97.1 Å²	97.1	11%	0.105	52%	0.524	C	S	.	.	H	α-helix	trans	-79.9	-29.1	179.6	-62.3	-173.7	0	0	0	113.4	D616 L646 V650 E658 G663	D616-L661 HydrophobicContact CB-CD2 3.57Å; L646-L661 HydrophobicContact CD2-CD1 4.36Å; L646-L661 HydrophobicContact CG-CD1 4.16Å; V650-L661 HydrophobicContact CB-CD1 4.08Å; V650-L661 HydrophobicContact CG1-CD1 4.1Å; V650-L661 HydrophobicContact CG2-CD1 3.74Å; E658-L661 PolarHBondContact O-N 3.23Å; L661-G663 PolarHBondContact O-N 3.36Å
662	S	65.7	Low	56.2	Low	65 Å²	65	98.7 Å²	98.7	46%	0.455	54%	0.542	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.4	4.1	-178.2	56.6	0	0	0	0	114.7	E658 N659 K664	E658-S662 PolarHBondContact O-N 3.03Å; E658-S662 PolarHBondContact O-OG 3.31Å; E658-S662 VanDerWaalsContact O-OG 3.14Å; N659-S662 WeakPolarHBondContact CA-OG 3.26Å; N659-S662 PolarHBondContact O-OG 2.77Å; S662-K664 PolarHBondContact O-N 3.2Å; S662-K664 VanDerWaalsContact O-N 3.15Å
663	G	54.9	Low	53.2	Low	59 Å²	59	100.9 Å²	100.9	61%	0.608	55%	0.552	S	S	*	*	T	Hydrogen-bonded Turn	trans	67	12	176.4	0	0	0	0	0	114.5	L661 T665	L661-G663 PolarHBondContact O-N 3.36Å; G663-T665 PolarHBondContact O-N 3Å
664	K	36	Very low	50.6	Low	152 Å²	152	103.8 Å²	103.8	66%	0.661	58%	0.575	S	S	*	*			trans	-79.2	74.2	168.3	-72.2	-176.9	-178.9	174.7	0	108.6	S662 I666	S662-K664 PolarHBondContact O-N 3.2Å; S662-K664 VanDerWaalsContact O-N 3.15Å; K664-I666 PolarHBondContact O-N 3.44Å
665	T	31.9	Very low	47.7	Very low	125 Å²	125	109.1 Å²	109.1	77%	0.767	61%	0.607	S	S	*	*			trans	-51.9	115.9	160.2	18	0	0	0	0	108.1	G663 A667	G663-T665 PolarHBondContact O-N 3Å; T665-A667 PolarHBondContact O-N 3.35Å
666	I	27.3	Very low	44.9	Very low	155 Å²	155	109.7 Å²	109.7	80%	0.795	61%	0.613	S	S	*	*			trans	-64.2	78.9	158.3	-59.4	170.2	0	0	0	105.5	K664	K664-I666 PolarHBondContact O-N 3.44Å
667	A	28.1	Very low	42	Very low	73 Å²	73	112 Å²	112	60%	0.603	63%	0.625	S	S	*	*			trans	-124.5	63	165.8	0	0	0	0	0	105.3	T665	T665-A667 PolarHBondContact O-N 3.35Å
668	N	27.6	Very low	39.4	Very low	149 Å²	149	118.8 Å²	118.8	80%	0.797	66%	0.661	S	S	*	*			trans	-167.9	69.9	167.7	-93.6	-15.8	0	0	0	106.4
669	D	24.7	Very low	36.8	Very low	155 Å²	155	121.2 Å²	121.2	83%	0.829	68%	0.682	S	S	*	*	S	Bend	trans	-166.3	127.4	144	-90.2	-29.1	0	0	0	107.2
670	L	25.8	Very low	34.2	Very low	171 Å²	171	122.3 Å²	122.3	90%	0.895	70%	0.696	S	S	*	*	S	Bend	trans	98.5	111.6	-176.7	-52.6	170.9	0	0	0	115.1
671	I	27.4	Very low	32	Very low	166 Å²	166	125.3 Å²	125.3	85%	0.851	72%	0.717	S	S	*	*			trans	90.5	62.7	176	-41.2	171.4	0	0	0	114.3	E673	I671-E673 PolarHBondContact O-N 2.82Å
672	N	20.2	Very low	29.6	Very low	162 Å²	162	130.2 Å²	130.2	87%	0.866	75%	0.748	S	S	*	*			trans	-55.9	113.8	136.3	-80.3	-33.1	0	0	0	109.1
673	E	23	Very low	27.8	Very low	179 Å²	179	134.1 Å²	134.1	84%	0.836	76%	0.763	S	S	*	*				170.3	153.2	124.2	-93	-143.4	141.5	0	0	112.3	I671	I671-E673 PolarHBondContact O-N 2.82Å
674	P	30.3	Very low	26.5	Very low	102 Å²	102	138 Å²	138	66%	0.662	77%	0.77	S	S	*	*			trans	-118.3	143.8	-132.6	37.8	-26.7	0	0	0	114.1
675	L	23.8	Very low	26.1	Very low	168 Å²	168	136.9 Å²	136.9	88%	0.88	78%	0.78	S	S	*	*			trans	-142.9	96.7	158.1	-78.2	175.4	0	0	0	111.9
676	S	23.1	Very low	25.8	Very low	89 Å²	89	138.3 Å²	138.3	62%	0.622	78%	0.781	S	S	*	*				34.6	129.8	129.6	71.7	0	0	0	0	122
677	N	22.7	Very low	25.7	Very low	140 Å²	140	137 Å²	137	75%	0.749	78%	0.783	S	S	*	*			trans	85	100.4	131	-69.6	-9.1	0	0	0	120.9
678	N	25.2	Very low	25.6	Very low	150 Å²	150	142.3 Å²	142.3	80%	0.802	80%	0.796	S	S	*	*				104.3	139	119.2	-79.9	-17.8	0	0	0	119.8
679	P	25.7	Very low	25.6	Very low	110 Å²	110	140.9 Å²	140.9	71%	0.714	79%	0.794	S	S	*	*			trans	-105.8	178.9	-164.7	40.8	-29	0	0	0	113.2
680	S	23.4	Very low	25.8	Very low	110 Å²	110	143.6 Å²	143.6	77%	0.769	79%	0.794	S	S	*	*			trans	92.7	104.5	164.2	75.8	0	0	0	0	117
681	V	30.4	Very low	25.7	Very low	131 Å²	131	141 Å²	141	79%	0.794	79%	0.785	S	S	*	*				-150.5	120.2	116	178.5	0	0	0	0	107.1
682	V	25.4	Very low	25.8	Very low	123 Å²	123	139.6 Å²	139.6	75%	0.745	78%	0.779	S	S	*	*			trans	-92.5	114.6	169.3	173.6	0	0	0	0	105.8
683	D	28	Very low	26	Very low	147 Å²	147	139.1 Å²	139.1	79%	0.786	78%	0.776	S	S	*	*			trans	-115.2	113	166.5	-107	-27	0	0	0	109.4
684	N	26.4	Very low	26.3	Very low	141 Å²	141	136.9 Å²	136.9	75%	0.754	78%	0.775	S	S	*	*			trans	-77.6	113.9	172.4	-74.1	-35.8	0	0	0	108.8
685	C	27.7	Very low	26.1	Very low	128 Å²	128	137.3 Å²	137.3	87%	0.865	78%	0.78	S	S	*	*			trans	-114.2	109.4	161.9	-88.7	0	0	0	0	109.6
686	I	26.7	Very low	26.5	Very low	155 Å²	155	134.9 Å²	134.9	80%	0.795	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-73.9	132.4	170.2	-63.8	167.6	0	0	0	107.7
687	P	25	Very low	26.9	Very low	127 Å²	127	136.9 Å²	136.9	83%	0.825	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-85.3	119.3	178.2	16.2	-3.8	0	0	0	111.9
688	E	25	Very low	27.2	Very low	186 Å²	186	135.6 Å²	135.6	87%	0.869	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-79.4	154	164	-91.4	-171.8	158.7	0	0	111.8
689	P	27.6	Very low	27.4	Very low	118 Å²	118	135.6 Å²	135.6	77%	0.766	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-85.9	133.1	-164.5	25.9	-17.1	0	0	0	113.2	V691	P689-V691 PolarHBondContact O-N 3.21Å
690	Y	29.1	Very low	27.6	Very low	212 Å²	212	138.9 Å²	138.9	83%	0.831	79%	0.785	S	S	*	*			trans	-74.7	108.3	-178	-157.2	-101.1	0	0	0	111.3	L692	Y690-L692 HydrophobicContact CD1-CG 4.33Å; Y690-L692 HydrophobicContact CE1-CD2 4.25Å
691	V	23.9	Very low	27.7	Very low	116 Å²	116	141.1 Å²	141.1	70%	0.703	79%	0.788	S	S	*	*			trans	-78.7	112.5	170.9	176.3	0	0	0	0	108.8	P689 N693	P689-V691 PolarHBondContact O-N 3.21Å; V691-N693 PolarHBondContact O-N 3.43Å; V691-N693 VanDerWaalsContact O-N 3.14Å
692	L	29	Very low	28	Very low	138 Å²	138	143.6 Å²	143.6	72%	0.723	79%	0.791	S	S	*	*			trans	-76.5	96	170.9	-85	161.8	0	0	0	110.1	Y690 T694	Y690-L692 HydrophobicContact CD1-CG 4.33Å; Y690-L692 HydrophobicContact CE1-CD2 4.25Å; L692-T694 PolarHBondContact O-N 3.1Å
693	N	24.6	Very low	28	Very low	151 Å²	151	144.7 Å²	144.7	81%	0.807	80%	0.797	S	S	*	*			trans	-67.6	108.1	160.7	-79.7	-23.7	0	0	0	109.3	V691	V691-N693 PolarHBondContact O-N 3.43Å; V691-N693 VanDerWaalsContact O-N 3.14Å
694	T	29.4	Very low	28.2	Very low	132 Å²	132	141 Å²	141	81%	0.81	79%	0.794	S	S	*	*			trans	-103.5	102.4	160.5	45	0	0	0	0	108	L692	L692-T694 PolarHBondContact O-N 3.1Å
695	S	26.7	Very low	28.7	Very low	111 Å²	111	147.5 Å²	147.5	78%	0.776	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-86.2	142.7	166.8	-153.7	0	0	0	0	108.7
696	P	31.4	Very low	28.7	Very low	118 Å²	118	148.5 Å²	148.5	77%	0.766	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-86.3	131.9	-168.9	16	-1.1	0	0	0	111.9
697	V	30.7	Very low	28.8	Very low	130 Å²	130	148.2 Å²	148.2	79%	0.788	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-92.1	125	171.5	177.2	0	0	0	0	109.6
698	P	30.6	Very low	29.1	Very low	114 Å²	114	149.3 Å²	149.3	74%	0.74	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-100.3	133	175	34.8	-26.7	0	0	0	111.8
699	L	29.3	Very low	29.3	Very low	149 Å²	149	147.2 Å²	147.2	78%	0.78	82%	0.816	S	S	*	*			trans	-142.6	95.4	167.3	-87.3	154.5	0	0	0	107.1
700	K	29.4	Very low	29.4	Very low	180 Å²	180	149 Å²	149	78%	0.783	82%	0.819	S	S	*	*				78.5	107.6	97.2	-89.5	-168.1	176	-175.2	0	113.8
701	N	26.2	Very low	29.4	Very low	157 Å²	157	144.8 Å²	144.8	84%	0.84	82%	0.818	S	S	*	*			trans	-52.4	131.6	150	-70.3	-20.8	0	0	0	110.3
702	E	34.7	Very low	29.8	Very low	183 Å²	183	146.9 Å²	146.9	86%	0.855	83%	0.826	S	S	*	*			trans	-131.1	148.2	147.6	-81.8	-171.9	171.9	0	0	109.5
703	V	26.9	Very low	29.9	Very low	146 Å²	146	147.5 Å²	147.5	89%	0.885	83%	0.834	S	S	*	*			trans	-116.6	152.8	-161.1	162.8	0	0	0	0	108.5
704	G	32.6	Very low	30.3	Very low	70 Å²	70	147.3 Å²	147.3	72%	0.722	84%	0.837	S	S	*	*			trans	119	128.9	158.9	0	0	0	0	0	112.1
705	E	35.8	Very low	30.4	Very low	277 Å²	277	148.6 Å²	148.6	100%	1.294	84%	0.839	S	S	*	*			cis	-128.9	0	16.3	-72.8	178.7	137.9	0	0	112.3

Retrieved 705 of 705 residues in 118.1 ms (Link to these results)

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