A0A5K4F2Q6_SCHMA Loading...

MAP kinase-activating death domain protein AlphaSync

AlphaFold DB , UniProt , Accession A0A5K4F2Q6, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,491 aa.

						>A0A5K4F2Q6_SCHMA|A0A5K4F2Q6
MFPNCDNLPYCPRLIDYLVFVGREGHSYSEEVYNQIPSILKCYPLLKHKDFVLPNDVVYFCQPEGCLSSTLSSTNMGTTTFVFTLTDKDSQKTRFGICLNFFRQCNIIDSACSNEDFKSRWDSNSTLGNASKDQILVNDNKQSILTSLCLISHHPFFSKFRQCLHSLKEIIDRCDEYFKKLYSVRSQSYSFWSTILSNQLAQQRNVDQLLFKVVYEIESWITNLLNAPVPIPGKTCLRLTVGPETLYEKLIFALPDKTRLTLIDFPLHLPLELLGMETCLKVLTAIMLEQKVVLQSRDYNALTMSVMAFTAMLYPLQYMFPAIPLLPNSLKGGENLLLSPTPFLIGIPATFLSQKTDFRFPADVWLVDLDANKMMGSSLLEPIPLLPEKESQILCENLDQALSSMTANLTPDESTEINLKNSANQLRNADSADVATRVAMVRFFNSLNVLGNITEHTRTIRLFPRPVVAFQKFSFLKSRQTLTPFTRKLAETQAVEFFAEWCLYPENEVFQRIHAGVHDPEQIGDKGIWYQDNLAQINFEIWSSEQTDRYLALNFIHSVNLNSDDITNFEMVHENFPKFNTVTNNNNIMYDLMSLYNPPQNMDDLLKNAIQPQQYMRKNKPKRRPNQQQLQPTDSFDLTNAQVQKTNSIENNEIALNKKSLPGRLLTIPSMAESTSDSSDDQDDSDIWDLKDSVSQSNIKENPNEVTHEDDMMRNKTNNVNHVQNIENKLTLTNTSNVPIIRKPSLRKVPTTQQANYTNTEMNKRSVHYNEEQLVQVLNKDAISTEDEVDKYEDADENEEESAAAEEEEMEDDEDDMEQTSVGKYLLNNLSDNLADAASHASTTLTGLLNKPKTIVRKSGSLMKKMATEIASTTKTTDTTGNKSSYINKPLDVNNNKPDGDLIHSASKFVLNFPKQQFFQFGANKSRQQETGLLSKNKNNKLTSGKGVDSNLVNPEQSYADQEFLREVVRYIHEGQANVQMKFSVNRLKELLSDENYRNYLLSKLNLGLSKSFDDPDECIPDVPIINMNGYKSHIWLLQCVIHGLEQTCTNHGIGGLASAMMLLELCHTHYLNMSTAVLPSKLHGSQYSTNQNSQEEENLVSAFTGWLRTTTKDLKKVTKPNIVTGLFSRPNHSENLINNENQSIDLTTEKVIIYIYIYIYIYIYDIFHYFINLHQTDDNNSKSFITMGQNDSDYMNKDTILGKKSQHASSYRFIHGNLIDPSVQNQSTADNTDNHSSKSDNKTISSSDHSLNRVYLYENLIDGHERSRLWDHMQFWEDTFFDTVAQERDILGLDQAPTEMLEEFANMNTTQKRIVMLKEDRLLAFCLYNLTAYMILMNVNKGILVNHVRRLLARCRIGSYFAAITSRLLDNVKYLDGNSIDLLPPMTRLKVFQSYEIEILSNVSNEATILEIYGKCLTVRNLSGEIIKKLNYDQLIDLSFEDSIISLNFNEQQTSYNQVSLLRIRCDKAKQICHTIERLMQRSDVENCQQ
					

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(Predicted Aligned Error values between residue pairs)

Download Structure AlphaSync Parameters PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	22.7	Very low	40.7	Very low	125 Å²	125	84.5 Å²	84.5	62%	0.616	46%	0.459	S	S	*	.				0	86.6	0	-80.9	-176	161.7	0	0	110.2	Q91	M1-Q91 VanDerWaalsContact CA-OE1 3.3Å
2	F	24.6	Very low	44.8	Very low	69 Å²	69	78.8 Å²	78.8	30%	0.303	43%	0.43	S	S	.	.			trans	-153.7	102.2	161.9	-93.1	-53	0	0	0	108	R465 F497	F2-R465 PolarHBondContact O-NH2 3.46Å; F2-F497 HydrophobicContact CD1-CZ 4.32Å; F2-F497 HydrophobicContact CD2-CE2 4.04Å; F2-F497 HydrophobicContact CE1-CE1 4.44Å; F2-F497 AromaticContact CE1-CE2 3.94Å; F2-F497 HydrophobicContact CE1-CE2 3.94Å; F2-F497 AromaticContact CE1-CZ 3.47Å; F2-F497 HydrophobicContact CE1-CZ 3.47Å; F2-F497 VanDerWaalsContact CE1-CZ 3.47Å; F2-F497 HydrophobicContact CE2-CD2 4.16Å; F2-F497 AromaticContact CE2-CE2 3.24Å; F2-F497 HydrophobicContact CE2-CE2 3.24Å; F2-F497 AromaticContact CE2-CZ 3.71Å; F2-F497 HydrophobicContact CE2-CZ 3.71Å; F2-F497 HydrophobicContact CZ-CD2 4.21Å; F2-F497 HydrophobicContact CZ-CE1 4.11Å; F2-F497 AromaticContact CZ-CE2 3.19Å; F2-F497 HydrophobicContact CZ-CE2 3.19Å; F2-F497 AromaticContact CZ-CZ 3.11Å; F2-F497 HydrophobicContact CZ-CZ 3.11Å
3	P	25.3	Very low	48.5	Very low	64 Å²	64	73.8 Å²	73.8	42%	0.416	40%	0.4	S	S	.	.			trans	-69.7	128.1	153.2	30.5	-27	0	0	0	107.3	C5 L8	P3-C5 PolarHBondContact O-N 2.86Å; P3-L8 HydrophobicContact CB-CD1 4.19Å
4	N	26.8	Very low	51.8	Low	76 Å²	76	68.5 Å²	68.5	41%	0.406	37%	0.372	S	S	.	.			trans	-67.4	97.1	154.9	-73.6	12.2	0	0	0	104.9	D6 N7 L8 R465	N4-D6 PolarHBondContact O-N 3.21Å; N4-N7 PolarHBondContact O-N 2.99Å; N4-L8 PolarHBondContact O-N 3.12Å; N4-R465 PolarHBondContact OD1-NH2 2.9Å
5	C	30.9	Very low	54.7	Low	76 Å²	76	63.9 Å²	63.9	51%	0.514	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.7	-18.7	-171.1	-77.3	0	0	0	0	114.3	P3	P3-C5 PolarHBondContact O-N 2.86Å
6	D	34.7	Very low	57.2	Low	88 Å²	88	59.9 Å²	59.9	47%	0.471	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.6	-5.8	179.5	-56.3	-44.3	0	0	0	113.7	N4 K257	N4-D6 PolarHBondContact O-N 3.21Å; D6-K257 VanDerWaalsContact CG-NZ 3.28Å; D6-K257 WeakPolarHBondContact OD1-CE 3.47Å; D6-K257 IonicContact OD1-NZ 2.74Å; D6-K257 PolarHBondContact OD1-NZ 3.14Å; D6-K257 IonicContact OD2-NZ 3.58Å; D6-K257 PolarHBondContact OD2-NZ 2.82Å
7	N	34.8	Very low	59.5	Low	106 Å²	106	56.4 Å²	56.4	57%	0.567	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-136.8	-7.2	-175.5	-87.5	-47.8	0	0	0	117.3	N4	N4-N7 PolarHBondContact O-N 2.99Å
8	L	40.7	Very low	61.6	Low	95 Å²	95	53.3 Å²	53.3	50%	0.497	29%	0.29	S	S	.	.	S	Bend	trans	-78.9	130	162.2	-89	89.3	0	0	0	109.3	P3 N4 Y10	P3-L8 HydrophobicContact CB-CD1 4.19Å; N4-L8 PolarHBondContact O-N 3.12Å; L8-Y10 PolarHBondContact O-N 3.42Å
9	P	51.8	Low	63.4	Low	124 Å²	124	50.5 Å²	50.5	81%	0.805	27%	0.274	S	S	*	.			trans	-63.2	113.9	-178.5	24.8	-33.2	0	0	0	110.2	C11	P9-C11 PolarHBondContact O-N 2.8Å
10	Y	69.6	Low	65	Low	93 Å²	93	48 Å²	48	37%	0.365	26%	0.261	S	S	.	.			trans	-56.4	119.5	177.8	-140.7	-95.3	0	0	0	109.2	L8 P12 H154 V229 P232 L254 M602	L8-Y10 PolarHBondContact O-N 3.42Å; Y10-P12 VanDerWaalsContact O-CD 3.25Å; Y10-P12 WeakPolarHBondContact O-CD 3.38Å; Y10-P12 VanDerWaalsContact O-N 3.11Å; Y10-H154 AromaticContact CE1-CE1 3.94Å; Y10-V229 HydrophobicContact CD1-CG1 4.38Å; Y10-V229 HydrophobicContact CE1-CG2 4.45Å; Y10-P232 HydrophobicContact CE1-CG 4.03Å; Y10-P232 HydrophobicContact CE2-CG 4.14Å; Y10-P232 WeakPolarHBondContact OH-CG 3.32Å; Y10-L254 HydrophobicContact CE1-CD1 3.83Å; Y10-L254 WeakPolarHBondContact OH-CD1 3.47Å; Y10-M602 HydrophobicContact CD1-CE 3.81Å; Y10-M602 HydrophobicContact CG-CE 4.28Å
11	C	85.9	Confident	66.3	Low	14 Å²	14	45.7 Å²	45.7	10%	0.095	25%	0.248	C	C	.	.			trans	-63.4	116.2	-175.7	-177.8	0	0	0	0	109.8	P9 R13 H153 H154 V229	P9-C11 PolarHBondContact O-N 2.8Å; C11-R13 PolarHBondContact O-N 2.95Å; C11-H153 HydrophobicContact CB-CB 4.27Å; C11-H153 VanDerWaalsContact SG-CE1 3.58Å; C11-H154 PolarHBondContact O-NE2 2.94Å; C11-V229 WeakPolarHBondContact O-CG1 3.44Å
12	P	90.1	Very high	69.5	Low	16 Å²	16	39.8 Å²	39.8	10%	0.104	22%	0.219	C	C	.	.			trans	-72	-14	-172.9	29.6	-37.5	0	0	0	113.6	Y10 V229 P599 M602 L605	Y10-P12 VanDerWaalsContact O-CD 3.25Å; Y10-P12 WeakPolarHBondContact O-CD 3.38Å; Y10-P12 VanDerWaalsContact O-N 3.11Å; P12-V229 PolarHBondContact O-N 3.31Å; P12-P599 HydrophobicContact CB-CB 4.23Å; P12-P599 HydrophobicContact CB-CG 4.32Å; P12-P599 WeakPolarHBondContact CG-O 3.43Å; P12-P599 VanDerWaalsContact O-CG 3.3Å; P12-P599 WeakPolarHBondContact O-CG 3.39Å; P12-M602 HydrophobicContact CB-SD 4.01Å; P12-L605 HydrophobicContact CB-CD1 4.3Å
13	R	92.2	Very high	72.2	Confident	13 Å²	13	39.5 Å²	39.5	5%	0.049	22%	0.216	C	C	.	.	B	Isolated β-bridge	trans	-83.5	135.9	179.6	-57.5	178.7	-62.6	-96.7	2.5	109.9	C11 D16 D50 H154 P598	C11-R13 PolarHBondContact O-N 2.95Å; R13-D16 IonicContact CZ-OD1 2.77Å; R13-D16 VanDerWaalsContact CZ-OD1 3.26Å; R13-D16 IonicContact NE-OD1 3.77Å; R13-D16 PolarHBondContact NE-OD1 2.95Å; R13-D16 IonicContact NH2-OD1 3.69Å; R13-D16 PolarHBondContact NH2-OD1 3Å; R13-D50 IonicContact CZ-OD2 2.72Å; R13-D50 IonicContact NH1-OD1 3.27Å; R13-D50 IonicContact NH1-OD2 3.67Å; R13-D50 PolarHBondContact NH1-OD2 2.86Å; R13-D50 VanDerWaalsContact NH1-OD2 3.08Å; R13-D50 IonicContact NH2-OD1 2.73Å; R13-D50 IonicContact NH2-OD2 3.18Å; R13-D50 PolarHBondContact NH2-OD2 2.88Å; R13-H154 PolarHBondContact O-CD2 3.26Å; R13-H154 VanDerWaalsContact O-CD2 3.29Å; R13-H154 PolarHBondContact O-NE2 3.49Å; R13-P598 HydrophobicContact CG-CB 4.04Å
14	L	94.6	Very high	74.4	Confident	0 Å²	0	43.1 Å²	43.1	0%	0	23%	0.227	C	C	.	.	S	Bend	trans	-74	-38.1	173.1	-175.5	68.5	0	0	0	111.9	S152 F156 F160 A227 L237 F252	L14-S152 PolarHBondContact O-OG 3.32Å; L14-F156 HydrophobicContact CD1-CD2 3.93Å; L14-F156 HydrophobicContact CD1-CE2 3.88Å; L14-F160 HydrophobicContact CD1-CE1 4.34Å; L14-F160 HydrophobicContact CD1-CZ 4.17Å; L14-F160 HydrophobicContact CD2-CE1 4.17Å; L14-F160 HydrophobicContact CG-CE1 3.89Å; L14-F160 HydrophobicContact CG-CZ 3.99Å; L14-F160 WeakPolarHBondContact O-CZ 3.4Å; L14-A227 HydrophobicContact CB-CB 4.3Å; L14-A227 VanDerWaalsContact CB-O 3.24Å; L14-A227 WeakPolarHBondContact CB-O 3.3Å; L14-A227 HydrophobicContact CD2-CB 4.07Å; L14-A227 PolarHBondContact N-O 2.93Å; L14-L237 HydrophobicContact CD2-CD2 3.63Å; L14-F252 HydrophobicContact CD1-CD1 3.93Å; L14-F252 HydrophobicContact CD1-CE1 4.34Å; L14-F252 HydrophobicContact CD1-CG 4.32Å; L14-F252 HydrophobicContact CD2-CD1 4.21Å; L14-F252 HydrophobicContact CD2-CD2 4.32Å; L14-F252 HydrophobicContact CD2-CE1 4.07Å; L14-F252 HydrophobicContact CD2-CE2 4.18Å; L14-F252 HydrophobicContact CD2-CG 4.33Å; L14-F252 HydrophobicContact CD2-CZ 4.05Å
15	I	95.6	Very high	75.8	Confident	0 Å²	0	42.7 Å²	42.7	0%	0	24%	0.241	C	C	.	.			trans	-134.9	136.1	-179.4	-60.8	168	0	0	0	107.5	L150 F160 L224 L225	I15-L150 HydrophobicContact CD1-CD1 4.16Å; I15-L150 HydrophobicContact CD1-CD2 4.37Å; I15-L150 HydrophobicContact CG2-CD2 3.92Å; I15-F160 HydrophobicContact CD1-CD1 3.94Å; I15-F160 HydrophobicContact CD1-CE1 3.74Å; I15-F160 HydrophobicContact CD1-CZ 4.5Å; I15-F160 HydrophobicContact CG1-CD1 4.08Å; I15-F160 HydrophobicContact CG1-CE1 3.49Å; I15-F160 VanDerWaalsContact CG1-CE1 3.49Å; I15-F160 HydrophobicContact CG1-CZ 3.77Å; I15-L224 HydrophobicContact CD1-CD1 3.88Å; I15-L224 HydrophobicContact CD1-CD2 4.23Å; I15-L224 HydrophobicContact CD1-CG 3.83Å; I15-L225 HydrophobicContact CB-CD2 4.09Å; I15-L225 HydrophobicContact CG2-CD2 3.5Å; I15-L225 VanDerWaalsContact CG2-CD2 3.5Å
16	D	94.9	Very high	76.5	Confident	0 Å²	0	48.1 Å²	48.1	0%	0	26%	0.258	C	S	.	.			trans	-95.2	-41.2	-178.7	-63.4	-88.9	0	0	0	112.5	R13 P44 H48 F51 I151 S152 H153	R13-D16 IonicContact CZ-OD1 2.77Å; R13-D16 VanDerWaalsContact CZ-OD1 3.26Å; R13-D16 IonicContact NE-OD1 3.77Å; R13-D16 PolarHBondContact NE-OD1 2.95Å; R13-D16 IonicContact NH2-OD1 3.69Å; R13-D16 PolarHBondContact NH2-OD1 3Å; D16-P44 VanDerWaalsContact O-CD 3.26Å; D16-P44 WeakPolarHBondContact O-CD 3.24Å; D16-H48 PolarHBondContact O-NE2 2.88Å; D16-F51 HydrophobicContact CB-CD1 3.57Å; D16-F51 HydrophobicContact CB-CE1 3.69Å; D16-F51 VanDerWaalsContact CG-CD1 3.46Å; D16-I151 PolarHBondContact N-O 2.6Å; D16-S152 WeakPolarHBondContact OD2-CA 3.02Å; D16-H153 VanDerWaalsContact CG-ND1 3.29Å; D16-H153 IonicContact OD1-CE1 3.59Å; D16-H153 PolarHBondContact OD1-CE1 3.27Å; D16-H153 VanDerWaalsContact OD1-CE1 3.32Å; D16-H153 IonicContact OD1-ND1 2.76Å; D16-H153 PolarHBondContact OD1-ND1 2.75Å; D16-H153 IonicContact OD2-CE1 3.56Å; D16-H153 IonicContact OD2-CG 2.69Å; D16-H153 PolarHBondContact OD2-N 3.24Å; D16-H153 IonicContact OD2-ND1 3.83Å; D16-H153 PolarHBondContact OD2-ND1 3.39Å
17	Y	96.8	Very high	76.8	Confident	0 Å²	0	46.7 Å²	46.7	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	151.1	179.9	-56.8	-86.4	0	0	0	113.8	Y43 H48 F51 L53 L150 I151	Y17-Y43 CarbonylContact C-O 3.54Å; Y17-Y43 VanDerWaalsContact CA-O 3.23Å; Y17-Y43 WeakPolarHBondContact CA-O 3.46Å; Y17-H48 AromaticContact CE1-CD2 3.98Å; Y17-H48 AromaticContact CE2-CD2 3.97Å; Y17-H48 AromaticContact CZ-CD2 3.61Å; Y17-H48 WeakPolarHBondContact OH-CB 3.39Å; Y17-H48 PolarHBondContact OH-N 2.87Å; Y17-F51 HydrophobicContact CD2-CD1 4.46Å; Y17-F51 AromaticContact CE2-CD1 3.97Å; Y17-F51 HydrophobicContact CE2-CD1 3.97Å; Y17-F51 VanDerWaalsContact CE2-O 3.25Å; Y17-F51 WeakPolarHBondContact CE2-O 3.17Å; Y17-F51 PolarHBondContact OH-O 2.93Å; Y17-L53 HydrophobicContact CD1-CB 4.47Å; Y17-L53 HydrophobicContact CD1-CD2 4.31Å; Y17-L53 HydrophobicContact CD2-CB 4.15Å; Y17-L53 HydrophobicContact CD2-CD1 4.24Å; Y17-L53 HydrophobicContact CE1-CB 4.17Å; Y17-L53 HydrophobicContact CE2-CB 3.82Å; Y17-L53 HydrophobicContact CG-CB 4.45Å; Y17-L53 HydrophobicContact CG-CD1 4.49Å; Y17-L53 HydrophobicContact CG-CD2 4.34Å; Y17-L150 WeakPolarHBondContact O-CA 3.46Å; Y17-I151 HydrophobicContact CD2-CB 4.32Å; Y17-I151 PolarHBondContact N-O 3.28Å; Y17-I151 VanDerWaalsContact N-O 3.15Å; Y17-I151 PolarHBondContact O-N 3.22Å
18	L	96.8	Very high	77.1	Confident	1 Å²	1	50.2 Å²	50.2	1%	0.005	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	124.6	161.9	-170.3	158	0	0	0	109.1	F20 C42 Y43 C149 L150 L167 I221	L18-F20 HydrophobicContact CD2-CD2 3.79Å; L18-F20 HydrophobicContact CD2-CE2 3.34Å; L18-F20 HydrophobicContact CD2-CZ 4.19Å; L18-C42 WeakPolarHBondContact O-CA 3.27Å; L18-Y43 HydrophobicContact CD2-CD2 4.29Å; L18-Y43 PolarHBondContact N-O 3.34Å; L18-Y43 PolarHBondContact O-N 3.48Å; L18-C149 CarbonylContact C-O 3.56Å; L18-C149 WeakPolarHBondContact CA-O 3.31Å; L18-L150 HydrophobicContact CB-CD2 3.84Å; L18-L150 HydrophobicContact CD1-CD2 3.68Å; L18-L150 HydrophobicContact CG-CD2 3.75Å; L18-L167 HydrophobicContact CD1-CD2 3.57Å; L18-L167 HydrophobicContact CD2-CD2 4.38Å; L18-I221 HydrophobicContact CB-CG2 4.24Å; L18-I221 HydrophobicContact CD1-CG1 4.26Å; L18-I221 HydrophobicContact CD1-CG2 3.96Å; L18-I221 HydrophobicContact CD2-CG2 4.5Å; L18-I221 HydrophobicContact CG-CG2 4.47Å
19	V	95.7	Very high	77.1	Confident	0 Å²	0	49.2 Å²	49.2	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	133.2	-171.5	-163.9	0	0	0	0	110.7	V21 I39 L53 C149 I151	V19-V21 HydrophobicContact CG1-CG2 3.82Å; V19-I39 HydrophobicContact CG1-CB 4.32Å; V19-I39 HydrophobicContact CG1-CD1 4.12Å; V19-I39 HydrophobicContact CG1-CG1 3.94Å; V19-I39 HydrophobicContact CG1-CG2 3.63Å; V19-L53 HydrophobicContact CG2-CD2 3.88Å; V19-C149 PolarHBondContact N-O 2.88Å; V19-C149 PolarHBondContact O-N 3.31Å; V19-I151 HydrophobicContact CG2-CG1 4.38Å
20	F	95	Very high	76.6	Confident	0 Å²	0	53.1 Å²	53.1	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	122.1	168.8	-66.9	-112.3	0	0	0	108	L18 L40 K41 Y43 S147 L148 I171 W192 L196 I221	L18-F20 HydrophobicContact CD2-CD2 3.79Å; L18-F20 HydrophobicContact CD2-CE2 3.34Å; L18-F20 HydrophobicContact CD2-CZ 4.19Å; F20-L40 HydrophobicContact CB-CB 4.33Å; F20-L40 PolarHBondContact O-N 3.23Å; F20-K41 HydrophobicContact CB-CB 4.24Å; F20-K41 HydrophobicContact CD2-CB 4.15Å; F20-K41 HydrophobicContact CG-CB 4.38Å; F20-K41 PolarHBondContact N-O 3.22Å; F20-K41 PolarHBondContact O-N 3.35Å; F20-Y43 HydrophobicContact CD2-CD2 4.48Å; F20-Y43 HydrophobicContact CD2-CE2 4.1Å; F20-Y43 HydrophobicContact CE2-CD2 4.09Å; F20-Y43 AromaticContact CE2-CE2 3.59Å; F20-Y43 HydrophobicContact CE2-CE2 3.59Å; F20-S147 WeakPolarHBondContact CA-O 3.5Å; F20-L148 HydrophobicContact CD1-CD2 3.44Å; F20-L148 VanDerWaalsContact CD1-CD2 3.44Å; F20-L148 HydrophobicContact CD2-CD2 4.25Å; F20-L148 HydrophobicContact CE1-CD2 3.31Å; F20-L148 HydrophobicContact CE2-CD2 4.09Å; F20-L148 HydrophobicContact CG-CD2 3.94Å; F20-L148 HydrophobicContact CZ-CD2 3.65Å; F20-I171 HydrophobicContact CE1-CD1 4.41Å; F20-I171 HydrophobicContact CZ-CD1 4.49Å; F20-W192 HydrophobicContact CD1-CZ3 4.43Å; F20-W192 HydrophobicContact CE1-CZ3 4.05Å; F20-L196 HydrophobicContact CB-CD2 3.69Å; F20-L196 HydrophobicContact CD1-CD2 3.45Å; F20-L196 VanDerWaalsContact CD1-CD2 3.45Å; F20-L196 HydrophobicContact CE1-CD2 4.26Å; F20-L196 HydrophobicContact CG-CD2 3.8Å; F20-I221 HydrophobicContact CE2-CD1 4.27Å; F20-I221 HydrophobicContact CZ-CD1 4.23Å
21	V	93.9	Very high	74.8	Confident	0 Å²	0	56.4 Å²	56.4	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	142	-178.4	175.9	0	0	0	0	110.9	V19 P37 S38 I39 V58 C61 Q62 S147	V19-V21 HydrophobicContact CG1-CG2 3.82Å; V21-P37 HydrophobicContact CG1-CB 3.94Å; V21-S38 VanDerWaalsContact CA-O 3.31Å; V21-S38 WeakPolarHBondContact CA-O 3.1Å; V21-S38 WeakPolarHBondContact CG1-O 3.26Å; V21-I39 HydrophobicContact CG2-CG1 4.45Å; V21-V58 HydrophobicContact CG1-CB 4.01Å; V21-V58 HydrophobicContact CG1-CG1 4.06Å; V21-V58 HydrophobicContact CG2-CG1 4.18Å; V21-C61 HydrophobicContact CB-CB 4.08Å; V21-C61 HydrophobicContact CG1-CB 4.02Å; V21-C61 HydrophobicContact CG2-CB 4.18Å; V21-Q62 HydrophobicContact CG1-CG 4.44Å; V21-Q62 PolarHBondContact O-NE2 2.78Å; V21-S147 PolarHBondContact N-O 2.66Å; V21-S147 PolarHBondContact O-N 3.32Å
22	G	90	Very high	72.7	Confident	0 Å²	0	61.1 Å²	61.1	0%	0	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	171.9	-156.2	176.3	0	0	0	0	0	112.7	S38	G22-S38 PolarHBondContact N-O 2.98Å; G22-S38 PolarHBondContact O-N 3.41Å; G22-S38 PolarHBondContact O-OG 3.46Å
23	R	81	Confident	70.6	Confident	63 Å²	63	71 Å²	71	24%	0.238	35%	0.354	C	S	.	.			trans	-85.3	129.4	-179.8	176.3	179.5	172.7	161.2	2.1	112.2	S27 Q35 C66 I144	R23-S27 PolarHBondContact NH2-O 3.09Å; R23-Q35 VanDerWaalsContact NH1-OE1 3.1Å; R23-C66 HydrophobicContact CB-CB 4.4Å; R23-I144 HydrophobicContact CB-CG2 4.08Å
24	E	69.8	Low	68.7	Low	140 Å²	140	74.5 Å²	74.5	65%	0.654	37%	0.374	S	S	*	.			trans	-79.4	140.8	170.5	-153.2	168.4	-164.9	0	0	111.2	H26 S38	E24-H26 VanDerWaalsContact C-N 3.33Å; E24-H26 PolarHBondContact O-N 2.83Å; E24-H26 VanDerWaalsContact O-N 3.07Å; E24-S38 PolarHBondContact N-OG 3.47Å
25	G	56.5	Low	67.3	Low	67 Å²	67	76.5 Å²	76.5	69%	0.691	38%	0.383	S	S	*	.	S	Bend	trans	-81.6	22.3	-158.4	0	0	0	0	0	118
26	H	47.5	Very low	66.5	Low	190 Å²	190	81.3 Å²	81.3	88%	0.88	41%	0.407	S	S	*	.			trans	-128.7	22	-159.6	-83.2	1.9	0	0	0	117.9	E24	E24-H26 VanDerWaalsContact C-N 3.33Å; E24-H26 PolarHBondContact O-N 2.83Å; E24-H26 VanDerWaalsContact O-N 3.07Å
27	S	39.3	Very low	66.1	Low	59 Å²	59	81.5 Å²	81.5	41%	0.413	41%	0.409	S	S	.	.			trans	-137.9	112.2	168.6	63.6	0	0	0	0	113.9	R23	R23-S27 PolarHBondContact NH2-O 3.09Å
28	Y	41.2	Very low	65.7	Low	180 Å²	180	82.6 Å²	82.6	71%	0.706	42%	0.416	S	S	*	.			trans	-86.1	99.3	155.7	-85.8	-90.4	0	0	0	108.9	I107	Y28-I107 WeakPolarHBondContact OH-CG2 3.37Å
29	S	41.2	Very low	65.5	Low	73 Å²	73	85.1 Å²	85.1	51%	0.51	43%	0.429	S	S	.	.			trans	-126.7	122	158.5	55.7	0	0	0	0	106.2	E31	S29-E31 PolarHBondContact O-N 3.22Å; S29-E31 VanDerWaalsContact O-N 3.09Å
30	E	40.3	Very low	65.2	Low	206 Å²	206	86.5 Å²	86.5	96%	0.963	44%	0.437	S	S	*	.	S	Bend	trans	-74.6	6.9	-173.4	-67.1	-173.3	128.9	0	0	113.9
31	E	33.7	Very low	65	Low	162 Å²	162	87.3 Å²	87.3	76%	0.757	44%	0.44	S	S	*	.			trans	-118.6	145.4	-178	-61.9	-172.1	160.4	0	0	112.2	S29	S29-E31 PolarHBondContact O-N 3.22Å; S29-E31 VanDerWaalsContact O-N 3.09Å
32	V	40.2	Very low	64.9	Low	114 Å²	114	88.4 Å²	88.4	69%	0.691	45%	0.448	S	S	*	.			trans	80.9	111.2	176.3	-167	0	0	0	0	116.5	N34	V32-N34 HydrophobicContact CG1-CB 4.49Å; V32-N34 PolarHBondContact O-N 2.94Å
33	Y	47.2	Very low	65.1	Low	224 Å²	224	88.5 Å²	88.5	88%	0.878	45%	0.448	S	S	*	.	S	Bend	trans	-69.5	-5.5	179	-85.6	-97	0	0	0	115.6
34	N	52.4	Low	65.6	Low	86 Å²	86	85.9 Å²	85.9	46%	0.46	44%	0.439	S	S	.	.			trans	-121.4	91.8	-177.7	-72.6	0.7	0	0	0	110.7	V32	V32-N34 HydrophobicContact CG1-CB 4.49Å; V32-N34 PolarHBondContact O-N 2.94Å
35	Q	65.1	Low	66.4	Low	41 Å²	41	84 Å²	84	19%	0.192	43%	0.433	C	S	.	.	B	Isolated β-bridge	trans	-88.3	149	171.8	-71	-177.2	-14.5	0	0	111.6	R23 C66	R23-Q35 VanDerWaalsContact NH1-OE1 3.1Å; Q35-C66 HydrophobicContact CB-CB 4.13Å; Q35-C66 WeakPolarHBondContact O-CB 3.48Å; Q35-C66 PolarHBondContact O-N 3.49Å
36	I	77.3	Confident	67.6	Low	101 Å²	101	86.7 Å²	86.7	52%	0.518	43%	0.431	S	S	.	.	P	Polyproline II helix	trans	-73.8	128.2	-177	-64	171.4	0	0	0	109.5	Y59	I36-Y59 HydrophobicContact CG2-CE1 3.97Å
37	P	86.8	Confident	69.4	Low	5 Å²	5	83 Å²	83	3%	0.032	41%	0.412	C	S	.	.	P	Polyproline II helix	trans	-69.7	147.3	176.7	29.2	-34.3	0	0	0	112.1	V21 V58 Y59 Q62 C66	V21-P37 HydrophobicContact CG1-CB 3.94Å; P37-V58 HydrophobicContact CB-CB 4.06Å; P37-V58 HydrophobicContact CG-CB 3.99Å; P37-V58 HydrophobicContact CG-CG2 4.12Å; P37-V58 VanDerWaalsContact CG-O 3.31Å; P37-V58 WeakPolarHBondContact CG-O 3.44Å; P37-V58 WeakPolarHBondContact O-CB 3.21Å; P37-V58 VanDerWaalsContact O-CG2 3.27Å; P37-V58 WeakPolarHBondContact O-CG2 3.41Å; P37-Y59 HydrophobicContact CG-CD1 4.21Å; P37-Q62 HydrophobicContact CB-CB 4.07Å; P37-Q62 HydrophobicContact CB-CG 4.45Å; P37-Q62 HydrophobicContact CG-CB 4.22Å; P37-C66 VanDerWaalsContact CA-SG 3.5Å
38	S	89.7	Confident	71.8	Confident	22 Å²	22	81.2 Å²	81.2	15%	0.154	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	153.4	-174.9	66.3	0	0	0	0	111.3	V21 G22 E24 L40	V21-S38 VanDerWaalsContact CA-O 3.31Å; V21-S38 WeakPolarHBondContact CA-O 3.1Å; V21-S38 WeakPolarHBondContact CG1-O 3.26Å; G22-S38 PolarHBondContact N-O 2.98Å; G22-S38 PolarHBondContact O-N 3.41Å; G22-S38 PolarHBondContact O-OG 3.46Å; E24-S38 PolarHBondContact N-OG 3.47Å; S38-L40 PolarHBondContact O-N 2.88Å
39	I	91.1	Very high	73.9	Confident	55 Å²	55	82.3 Å²	82.3	28%	0.282	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	111.3	171.1	-61.4	179.8	0	0	0	108.1	V19 V21 C42 L53 V57 V58	V19-I39 HydrophobicContact CG1-CB 4.32Å; V19-I39 HydrophobicContact CG1-CD1 4.12Å; V19-I39 HydrophobicContact CG1-CG1 3.94Å; V19-I39 HydrophobicContact CG1-CG2 3.63Å; V21-I39 HydrophobicContact CG2-CG1 4.45Å; I39-C42 HydrophobicContact CG2-CB 4.07Å; I39-L53 HydrophobicContact CD1-CD2 4.3Å; I39-V57 HydrophobicContact CD1-CG1 4.04Å; I39-V58 HydrophobicContact CD1-CG1 4.37Å; I39-V58 HydrophobicContact CG1-CG1 3.51Å
40	L	89.8	Confident	76	Confident	29 Å²	29	82.6 Å²	82.6	15%	0.152	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	-41	178.1	-56.4	-179.8	0	0	0	111.4	F20 S38 L196	F20-L40 HydrophobicContact CB-CB 4.33Å; F20-L40 PolarHBondContact O-N 3.23Å; S38-L40 PolarHBondContact O-N 2.88Å; L40-L196 HydrophobicContact CB-CD2 3.95Å; L40-L196 HydrophobicContact CD1-CD1 4.05Å; L40-L196 HydrophobicContact CD1-CD2 4.1Å
41	K	91	Very high	78.4	Confident	17 Å²	17	72.8 Å²	72.8	7%	0.074	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.5	148.8	178	-153.3	161.7	-177.2	179.9	0	110.2	F20 Y43 I195 E218	F20-K41 HydrophobicContact CB-CB 4.24Å; F20-K41 HydrophobicContact CD2-CB 4.15Å; F20-K41 HydrophobicContact CG-CB 4.38Å; F20-K41 PolarHBondContact N-O 3.22Å; F20-K41 PolarHBondContact O-N 3.35Å; K41-Y43 HydrophobicContact CD-CE2 4.22Å; K41-Y43 WeakPolarHBondContact CD-OH 3.26Å; K41-Y43 WeakPolarHBondContact CE-OH 3.47Å; K41-Y43 HydrophobicContact CG-CE2 4.01Å; K41-Y43 PolarHBondContact NZ-OH 3.45Å; K41-I195 WeakPolarHBondContact CD-O 3.38Å; K41-I195 PolarHBondContact NZ-O 3.27Å; K41-E218 IonicContact NZ-OE1 3.54Å; K41-E218 PolarHBondContact NZ-OE1 3.3Å
42	C	92.6	Very high	81	Confident	23 Å²	23	68.8 Å²	68.8	16%	0.155	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	139	-178.1	-174.1	0	0	0	0	110	L18 I39 L45	L18-C42 WeakPolarHBondContact O-CA 3.27Å; I39-C42 HydrophobicContact CG2-CB 4.07Å; C42-L45 WeakPolarHBondContact O-CD2 3.46Å
43	Y	93.7	Very high	83.4	Confident	2 Å²	2	63.5 Å²	63.5	1%	0.008	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	139.8	174	-58.7	-93.9	0	0	0	108.8	Y17 L18 F20 K41 E218 I221 L592	Y17-Y43 CarbonylContact C-O 3.54Å; Y17-Y43 VanDerWaalsContact CA-O 3.23Å; Y17-Y43 WeakPolarHBondContact CA-O 3.46Å; L18-Y43 HydrophobicContact CD2-CD2 4.29Å; L18-Y43 PolarHBondContact N-O 3.34Å; L18-Y43 PolarHBondContact O-N 3.48Å; F20-Y43 HydrophobicContact CD2-CD2 4.48Å; F20-Y43 HydrophobicContact CD2-CE2 4.1Å; F20-Y43 HydrophobicContact CE2-CD2 4.09Å; F20-Y43 AromaticContact CE2-CE2 3.59Å; F20-Y43 HydrophobicContact CE2-CE2 3.59Å; K41-Y43 HydrophobicContact CD-CE2 4.22Å; K41-Y43 WeakPolarHBondContact CD-OH 3.26Å; K41-Y43 WeakPolarHBondContact CE-OH 3.47Å; K41-Y43 HydrophobicContact CG-CE2 4.01Å; K41-Y43 PolarHBondContact NZ-OH 3.45Å; Y43-E218 HydrophobicContact CE1-CB 4.42Å; Y43-E218 HydrophobicContact CE1-CG 4.2Å; Y43-E218 WeakPolarHBondContact OH-CG 3.33Å; Y43-E218 PolarHBondContact OH-OE1 2.71Å; Y43-I221 HydrophobicContact CD1-CG2 4.15Å; Y43-I221 HydrophobicContact CD2-CD1 4.47Å; Y43-I221 HydrophobicContact CD2-CG2 3.92Å; Y43-I221 HydrophobicContact CE2-CD1 4.14Å; Y43-I221 HydrophobicContact CG-CG2 3.69Å; Y43-L592 HydrophobicContact CD1-CD2 4.11Å; Y43-L592 HydrophobicContact CE1-CD2 3.8Å
44	P	92.1	Very high	85.4	Confident	7 Å²	7	54.6 Å²	54.6	5%	0.045	28%	0.279	C	S	.	.	S	Bend	cis	-65.1	158.1	-9.1	31.1	-38	0	0	0	112.5	D16 L46 Y596	D16-P44 VanDerWaalsContact O-CD 3.26Å; D16-P44 WeakPolarHBondContact O-CD 3.24Å; P44-L46 VanDerWaalsContact C-N 3.27Å; P44-L46 WeakPolarHBondContact CG-O 3.32Å; P44-L46 PolarHBondContact O-N 3.04Å; P44-Y596 HydrophobicContact CB-CD1 3.61Å; P44-Y596 HydrophobicContact CB-CD2 4.33Å; P44-Y596 HydrophobicContact CB-CE1 3.4Å; P44-Y596 HydrophobicContact CB-CE2 4.2Å; P44-Y596 HydrophobicContact CB-CG 4.07Å; P44-Y596 HydrophobicContact CG-CD1 4.3Å; P44-Y596 HydrophobicContact CG-CE1 3.57Å; P44-Y596 HydrophobicContact CG-CE2 4.47Å
45	L	85	Confident	87.1	Confident	100 Å²	100	55.8 Å²	55.8	52%	0.524	29%	0.286	S	S	.	.	S	Bend	trans	-68.4	-27.9	178.9	-56.8	173.6	0	0	0	112.3	C42 M593	C42-L45 WeakPolarHBondContact O-CD2 3.46Å; L45-M593 HydrophobicContact CB-CE 4.09Å; L45-M593 HydrophobicContact CB-SD 3.63Å; L45-M593 HydrophobicContact CD1-CG 4.3Å; L45-M593 HydrophobicContact CD1-SD 3.71Å; L45-M593 HydrophobicContact CG-SD 3.82Å
46	L	82.9	Confident	88.2	Confident	125 Å²	125	57.7 Å²	57.7	65%	0.654	30%	0.298	S	S	*	.	S	Bend	trans	-89	117.3	171.1	-81.7	165.7	0	0	0	109.5	P44 M593	P44-L46 VanDerWaalsContact C-N 3.27Å; P44-L46 WeakPolarHBondContact CG-O 3.32Å; P44-L46 PolarHBondContact O-N 3.04Å; L46-M593 HydrophobicContact CB-CE 3.81Å; L46-M593 HydrophobicContact CD1-CE 3.66Å; L46-M593 HydrophobicContact CG-CE 3.73Å
47	K	84.7	Confident	89	Confident	112 Å²	112	52.9 Å²	52.9	49%	0.487	27%	0.273	S	S	.	.	P	Polyproline II helix	trans	-69.1	140.5	176.2	-63.6	-172	177.3	-169.2	0	111.5
48	H	88.9	Confident	89.3	Confident	21 Å²	21	53.1 Å²	53.1	10%	0.097	27%	0.274	C	S	.	.	P	Polyproline II helix	trans	-70.2	135.1	174.2	-60.9	-55.5	0	0	0	111	D16 Y17 F51 Y596	D16-H48 PolarHBondContact O-NE2 2.88Å; Y17-H48 AromaticContact CE1-CD2 3.98Å; Y17-H48 AromaticContact CE2-CD2 3.97Å; Y17-H48 AromaticContact CZ-CD2 3.61Å; Y17-H48 WeakPolarHBondContact OH-CB 3.39Å; Y17-H48 PolarHBondContact OH-N 2.87Å; H48-F51 HydrophobicContact CB-CB 4.36Å; H48-F51 CarbonylContact O-C 3.56Å; H48-Y596 AromaticContact CE1-CE1 3.91Å; H48-Y596 AromaticContact CE1-CZ 3.94Å; H48-Y596 PolarHBondContact CE1-OH 2.75Å; H48-Y596 PolarHBondContact NE2-OH 3.08Å
49	K	85.6	Confident	89.5	Confident	203 Å²	203	54 Å²	54	88%	0.883	27%	0.274	S	S	*	.	S	Bend	trans	-78.1	-37.4	178.1	-66.7	-176	-179.7	-179.2	0	112.2	F51	K49-F51 VanDerWaalsContact C-N 3.3Å
50	D	86.6	Confident	89.6	Confident	79 Å²	79	52.4 Å²	52.4	42%	0.422	27%	0.265	S	S	.	.	S	Bend	trans	-73.7	-20.6	178	57.9	-56.7	0	0	0	113	R13 K92	R13-D50 IonicContact CZ-OD2 2.72Å; R13-D50 IonicContact NH1-OD1 3.27Å; R13-D50 IonicContact NH1-OD2 3.67Å; R13-D50 PolarHBondContact NH1-OD2 2.86Å; R13-D50 VanDerWaalsContact NH1-OD2 3.08Å; R13-D50 IonicContact NH2-OD1 2.73Å; R13-D50 IonicContact NH2-OD2 3.18Å; R13-D50 PolarHBondContact NH2-OD2 2.88Å; D50-K92 PolarHBondContact O-NZ 2.95Å
51	F	89.2	Confident	89.8	Confident	0 Å²	0	51 Å²	51	0%	0	26%	0.258	C	S	.	.	S	Bend	trans	-145.2	74.5	-178	-164.9	-117.5	0	0	0	111.1	D16 Y17 H48 K49 L53 K92 R94 I151 H153	D16-F51 HydrophobicContact CB-CD1 3.57Å; D16-F51 HydrophobicContact CB-CE1 3.69Å; D16-F51 VanDerWaalsContact CG-CD1 3.46Å; Y17-F51 HydrophobicContact CD2-CD1 4.46Å; Y17-F51 AromaticContact CE2-CD1 3.97Å; Y17-F51 HydrophobicContact CE2-CD1 3.97Å; Y17-F51 VanDerWaalsContact CE2-O 3.25Å; Y17-F51 WeakPolarHBondContact CE2-O 3.17Å; Y17-F51 PolarHBondContact OH-O 2.93Å; H48-F51 HydrophobicContact CB-CB 4.36Å; H48-F51 CarbonylContact O-C 3.56Å; K49-F51 VanDerWaalsContact C-N 3.3Å; F51-L53 PolarHBondContact O-N 3.07Å; F51-K92 HydrophobicContact CD2-CD 4.25Å; F51-R94 HydrophobicContact CE1-CG 4.36Å; F51-R94 HydrophobicContact CE2-CB 4.36Å; F51-R94 HydrophobicContact CE2-CG 3.62Å; F51-R94 HydrophobicContact CZ-CB 3.77Å; F51-R94 HydrophobicContact CZ-CG 3.49Å; F51-R94 VanDerWaalsContact CZ-CG 3.49Å; F51-I151 HydrophobicContact CE1-CG2 4.08Å; F51-H153 AromaticContact CD1-CE1 3.53Å; F51-H153 AromaticContact CD1-ND1 3.92Å; F51-H153 AromaticContact CD2-CE1 3.19Å; F51-H153 WeakPolarHBondContact CD2-CE1 3.39Å; F51-H153 AromaticContact CD2-ND1 3.99Å; F51-H153 AromaticContact CD2-NE2 3.17Å; F51-H153 WeakPolarHBondContact CD2-NE2 3.48Å; F51-H153 AromaticContact CE1-CE1 3.78Å; F51-H153 AromaticContact CE1-ND1 3.75Å; F51-H153 AromaticContact CE2-CD2 3.71Å; F51-H153 AromaticContact CE2-CE1 3.44Å; F51-H153 VanDerWaalsContact CE2-CE1 3.44Å; F51-H153 WeakPolarHBondContact CE2-CE1 3.08Å; F51-H153 AromaticContact CE2-CG 3.97Å; F51-H153 AromaticContact CE2-ND1 3.8Å; F51-H153 AromaticContact CE2-NE2 3.37Å; F51-H153 WeakPolarHBondContact CE2-NE2 3.4Å; F51-H153 AromaticContact CG-CE1 3.2Å; F51-H153 WeakPolarHBondContact CG-CE1 3.36Å; F51-H153 AromaticContact CG-NE2 3.69Å; F51-H153 AromaticContact CZ-CE1 3.71Å; F51-H153 AromaticContact CZ-CG 3.98Å; F51-H153 AromaticContact CZ-ND1 3.66Å
52	V	89.6	Confident	89.9	Confident	78 Å²	78	50.2 Å²	50.2	47%	0.473	26%	0.255	S	S	.	.	P	Polyproline II helix	trans	-66	133.2	-179.8	-177.5	0	0	0	0	110.4	P54 R94	V52-P54 WeakPolarHBondContact O-CD 3.45Å; V52-R94 PolarHBondContact O-NE 2.98Å; V52-R94 PolarHBondContact O-NH2 3.1Å; V52-R94 VanDerWaalsContact O-NH2 3.11Å
53	L	90.8	Very high	89.8	Confident	4 Å²	4	49.2 Å²	49.2	2%	0.021	25%	0.248	C	C	.	.	P	Polyproline II helix	trans	-76.3	116	171.7	179.9	65.7	0	0	0	110.5	Y17 V19 I39 F51 V57 I151	Y17-L53 HydrophobicContact CD1-CB 4.47Å; Y17-L53 HydrophobicContact CD1-CD2 4.31Å; Y17-L53 HydrophobicContact CD2-CB 4.15Å; Y17-L53 HydrophobicContact CD2-CD1 4.24Å; Y17-L53 HydrophobicContact CE1-CB 4.17Å; Y17-L53 HydrophobicContact CE2-CB 3.82Å; Y17-L53 HydrophobicContact CG-CB 4.45Å; Y17-L53 HydrophobicContact CG-CD1 4.49Å; Y17-L53 HydrophobicContact CG-CD2 4.34Å; V19-L53 HydrophobicContact CG2-CD2 3.88Å; I39-L53 HydrophobicContact CD1-CD2 4.3Å; F51-L53 PolarHBondContact O-N 3.07Å; L53-V57 HydrophobicContact CD1-CB 4.48Å; L53-V57 HydrophobicContact CD1-CG1 4.3Å; L53-V57 HydrophobicContact CD1-CG2 4.42Å; L53-I151 HydrophobicContact CD1-CG1 3.87Å
54	P	89.5	Confident	89.6	Confident	36 Å²	36	51.1 Å²	51.1	23%	0.234	26%	0.257	C	S	.	.	P	Polyproline II helix	trans	-67.6	142.8	176.4	-18.4	33	0	0	0	111.4	V52 D56 V57 L85	V52-P54 WeakPolarHBondContact O-CD 3.45Å; P54-D56 VanDerWaalsContact C-N 3.26Å; P54-D56 PolarHBondContact O-N 2.67Å; P54-V57 WeakPolarHBondContact O-CB 3.38Å; P54-V57 VanDerWaalsContact O-CG1 3.25Å; P54-V57 WeakPolarHBondContact O-CG1 3.34Å; P54-V57 PolarHBondContact O-N 3.26Å; P54-L85 HydrophobicContact CG-CD1 4.27Å
55	N	87.3	Confident	89.2	Confident	111 Å²	111	50.9 Å²	50.9	59%	0.594	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.5	-30.4	177.2	-69.1	-18.4	0	0	0	111.9	V57 V58	N55-V57 PolarHBondContact O-N 3.01Å; N55-V58 WeakPolarHBondContact O-CG2 3.39Å; N55-V58 PolarHBondContact O-N 2.86Å
56	D	89	Confident	88.8	Confident	82 Å²	82	46.5 Å²	46.5	44%	0.439	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-11.3	-177.6	-57.1	-53.4	0	0	0	114.2	P54 V58 Y59 F60	P54-D56 VanDerWaalsContact C-N 3.26Å; P54-D56 PolarHBondContact O-N 2.67Å; D56-V58 PolarHBondContact O-N 3.2Å; D56-Y59 HydrophobicContact CB-CD2 3.98Å; D56-Y59 HydrophobicContact CB-CE2 4.4Å; D56-Y59 WeakPolarHBondContact O-CB 3.32Å; D56-Y59 WeakPolarHBondContact O-CD2 3.42Å; D56-Y59 PolarHBondContact O-N 3.47Å; D56-F60 WeakPolarHBondContact O-CD2 3.46Å
57	V	93	Very high	88.7	Confident	0 Å²	0	43.5 Å²	43.5	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-48.3	-31.5	174.6	72.1	0	0	0	0	112.7	I39 L53 P54 N55 Y59 F60 C61 F83 L85 I151	I39-V57 HydrophobicContact CD1-CG1 4.04Å; L53-V57 HydrophobicContact CD1-CB 4.48Å; L53-V57 HydrophobicContact CD1-CG1 4.3Å; L53-V57 HydrophobicContact CD1-CG2 4.42Å; P54-V57 WeakPolarHBondContact O-CB 3.38Å; P54-V57 VanDerWaalsContact O-CG1 3.25Å; P54-V57 WeakPolarHBondContact O-CG1 3.34Å; P54-V57 PolarHBondContact O-N 3.26Å; N55-V57 PolarHBondContact O-N 3.01Å; V57-Y59 VanDerWaalsContact C-N 3.31Å; V57-Y59 PolarHBondContact O-N 3.38Å; V57-F60 PolarHBondContact O-N 2.77Å; V57-C61 PolarHBondContact O-N 2.96Å; V57-C61 PolarHBondContact O-SG 3.27Å; V57-F83 HydrophobicContact CG2-CE2 3.98Å; V57-F83 HydrophobicContact CG2-CZ 3.75Å; V57-L85 HydrophobicContact CB-CD1 4.22Å; V57-L85 HydrophobicContact CG2-CD1 4.28Å; V57-I151 HydrophobicContact CG2-CD1 3.75Å
58	V	93.9	Very high	88.1	Confident	9 Å²	9	40.9 Å²	40.9	6%	0.055	21%	0.214	C	C	.	.	H	α-helix	trans	-59.7	-37.4	177.6	-61.4	0	0	0	0	113.4	V21 P37 I39 N55 D56 F60 C61 Q62	V21-V58 HydrophobicContact CG1-CB 4.01Å; V21-V58 HydrophobicContact CG1-CG1 4.06Å; V21-V58 HydrophobicContact CG2-CG1 4.18Å; P37-V58 HydrophobicContact CB-CB 4.06Å; P37-V58 HydrophobicContact CG-CB 3.99Å; P37-V58 HydrophobicContact CG-CG2 4.12Å; P37-V58 VanDerWaalsContact CG-O 3.31Å; P37-V58 WeakPolarHBondContact CG-O 3.44Å; P37-V58 WeakPolarHBondContact O-CB 3.21Å; P37-V58 VanDerWaalsContact O-CG2 3.27Å; P37-V58 WeakPolarHBondContact O-CG2 3.41Å; I39-V58 HydrophobicContact CD1-CG1 4.37Å; I39-V58 HydrophobicContact CG1-CG1 3.51Å; N55-V58 WeakPolarHBondContact O-CG2 3.39Å; N55-V58 PolarHBondContact O-N 2.86Å; D56-V58 PolarHBondContact O-N 3.2Å; V58-F60 VanDerWaalsContact C-N 3.34Å; V58-C61 PolarHBondContact O-N 3.36Å; V58-Q62 PolarHBondContact O-N 3Å; V58-Q62 VanDerWaalsContact O-N 3.09Å
59	Y	92.6	Very high	87.1	Confident	41 Å²	41	41.5 Å²	41.5	16%	0.161	22%	0.22	C	C	.	.	H	α-helix	trans	-69.7	-34.4	179.3	-58.8	-64.2	0	0	0	111.3	I36 P37 D56 V57 Q62 P63 P327 L330	I36-Y59 HydrophobicContact CG2-CE1 3.97Å; P37-Y59 HydrophobicContact CG-CD1 4.21Å; D56-Y59 HydrophobicContact CB-CD2 3.98Å; D56-Y59 HydrophobicContact CB-CE2 4.4Å; D56-Y59 WeakPolarHBondContact O-CB 3.32Å; D56-Y59 WeakPolarHBondContact O-CD2 3.42Å; D56-Y59 PolarHBondContact O-N 3.47Å; V57-Y59 VanDerWaalsContact C-N 3.31Å; V57-Y59 PolarHBondContact O-N 3.38Å; Y59-Q62 CarbonylContact O-C 3.55Å; Y59-P63 WeakPolarHBondContact O-CA 3.32Å; Y59-P327 VanDerWaalsContact O-CB 3.25Å; Y59-P327 WeakPolarHBondContact O-CB 3.31Å; Y59-L330 HydrophobicContact CD2-CD1 4.09Å; Y59-L330 HydrophobicContact CE2-CD1 4.46Å
60	F	93.9	Very high	85.8	Confident	21 Å²	21	37.5 Å²	37.5	9%	0.092	21%	0.213	C	C	.	.	H	α-helix	trans	-77.5	-33.5	177.4	-64.6	-98.9	0	0	0	111.8	D56 V57 V58 Q62 F81 F83 L85 L325 P327	D56-F60 WeakPolarHBondContact O-CD2 3.46Å; V57-F60 PolarHBondContact O-N 2.77Å; V58-F60 VanDerWaalsContact C-N 3.34Å; F60-Q62 VanDerWaalsContact C-N 3.33Å; F60-Q62 PolarHBondContact O-N 3.18Å; F60-F81 VanDerWaalsContact O-CE2 3.22Å; F60-F81 WeakPolarHBondContact O-CE2 3.44Å; F60-F81 WeakPolarHBondContact O-CZ 3.25Å; F60-F83 HydrophobicContact CB-CB 4.22Å; F60-F83 HydrophobicContact CB-CD1 3.77Å; F60-F83 HydrophobicContact CB-CD2 3.56Å; F60-F83 HydrophobicContact CB-CE1 3.92Å; F60-F83 HydrophobicContact CB-CE2 3.73Å; F60-F83 HydrophobicContact CB-CG 3.59Å; F60-F83 HydrophobicContact CB-CZ 3.9Å; F60-F83 HydrophobicContact CD1-CB 4.1Å; F60-F83 HydrophobicContact CD1-CD2 4.2Å; F60-F83 HydrophobicContact CD1-CG 4.27Å; F60-F83 HydrophobicContact CG-CD2 4.02Å; F60-F83 HydrophobicContact CG-CE2 4.41Å; F60-F83 HydrophobicContact CG-CG 4.28Å; F60-L85 HydrophobicContact CD1-CD2 4.13Å; F60-L85 HydrophobicContact CD2-CD2 3.64Å; F60-L85 HydrophobicContact CE1-CD2 3.94Å; F60-L85 HydrophobicContact CE2-CD2 3.46Å; F60-L85 VanDerWaalsContact CE2-CD2 3.46Å; F60-L85 HydrophobicContact CG-CD2 3.99Å; F60-L85 HydrophobicContact CZ-CD2 3.61Å; F60-L325 WeakPolarHBondContact CD1-O 3.38Å; F60-L325 VanDerWaalsContact CE1-O 3.24Å; F60-L325 WeakPolarHBondContact CE1-O 3.32Å; F60-P327 HydrophobicContact CD1-CG 4.17Å; F60-P327 HydrophobicContact CD2-CG 4.29Å; F60-P327 HydrophobicContact CE1-CG 4.17Å; F60-P327 HydrophobicContact CE2-CG 4.27Å; F60-P327 HydrophobicContact CG-CG 4.24Å; F60-P327 HydrophobicContact CZ-CG 4.21Å
61	C	94.7	Very high	84.2	Confident	0 Å²	0	40 Å²	40	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-64.1	-35.9	170.9	-66.1	0	0	0	0	112.8	V21 V57 V58 N100 S147 C149	V21-C61 HydrophobicContact CB-CB 4.08Å; V21-C61 HydrophobicContact CG1-CB 4.02Å; V21-C61 HydrophobicContact CG2-CB 4.18Å; V57-C61 PolarHBondContact O-N 2.96Å; V57-C61 PolarHBondContact O-SG 3.27Å; V58-C61 PolarHBondContact O-N 3.36Å; C61-N100 PolarHBondContact O-ND2 3.02Å; C61-N100 PolarHBondContact O-OD1 3.2Å; C61-S147 PolarHBondContact O-OG 2.78Å; C61-C149 VanDerWaalsContact SG-CB 3.57Å
62	Q	93.1	Very high	82.3	Confident	1 Å²	1	45.1 Å²	45.1	1%	0.005	26%	0.262	C	S	.	.	S	Bend	trans	-130.6	80.4	179.3	-62.4	-167.6	-3.8	0	0	110.6	V21 P37 V58 Y59 F60 E64 G65 C66 L145 S147 S329	V21-Q62 HydrophobicContact CG1-CG 4.44Å; V21-Q62 PolarHBondContact O-NE2 2.78Å; P37-Q62 HydrophobicContact CB-CB 4.07Å; P37-Q62 HydrophobicContact CB-CG 4.45Å; P37-Q62 HydrophobicContact CG-CB 4.22Å; V58-Q62 PolarHBondContact O-N 3Å; V58-Q62 VanDerWaalsContact O-N 3.09Å; Y59-Q62 CarbonylContact O-C 3.55Å; F60-Q62 VanDerWaalsContact C-N 3.33Å; F60-Q62 PolarHBondContact O-N 3.18Å; Q62-E64 VanDerWaalsContact C-N 3.28Å; Q62-E64 PolarHBondContact O-N 3.39Å; Q62-G65 PolarHBondContact O-N 3.04Å; Q62-C66 PolarHBondContact OE1-SG 3.37Å; Q62-L145 HydrophobicContact CG-CD2 4.05Å; Q62-L145 HydrophobicContact CG-CG 4.5Å; Q62-L145 PolarHBondContact NE2-O 2.62Å; Q62-S147 VanDerWaalsContact CG-OG 3.25Å; Q62-S147 WeakPolarHBondContact CG-OG 3.38Å; Q62-S147 PolarHBondContact NE2-OG 3.49Å; Q62-S329 PolarHBondContact O-OG 2.77Å
63	P	90.9	Very high	80.3	Confident	2 Å²	2	42.5 Å²	42.5	1%	0.013	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-26.9	-170.8	24.2	-35.4	0	0	0	114.8	Y59 Y299 L325 P327 N328 S329 P348	Y59-P63 WeakPolarHBondContact O-CA 3.32Å; P63-Y299 HydrophobicContact CG-CD2 3.79Å; P63-Y299 HydrophobicContact CG-CE1 4.37Å; P63-Y299 HydrophobicContact CG-CE2 3.39Å; P63-Y299 HydrophobicContact CG-CG 4.43Å; P63-L325 HydrophobicContact CB-CD2 4.15Å; P63-L325 HydrophobicContact CG-CD2 4.19Å; P63-P327 HydrophobicContact CB-CB 3.68Å; P63-N328 WeakPolarHBondContact O-CB 3.25Å; P63-N328 PolarHBondContact O-N 2.84Å; P63-S329 PolarHBondContact O-N 3.45Å; P63-S329 PolarHBondContact O-OG 2.92Å; P63-P348 HydrophobicContact CB-CG 4.47Å
64	E	88	Confident	78.1	Confident	41 Å²	41	48 Å²	48	19%	0.192	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.5	3.2	173.5	-68.8	-177.8	-176.6	0	0	113.3	Q62 Y299 T350	Q62-E64 VanDerWaalsContact C-N 3.28Å; Q62-E64 PolarHBondContact O-N 3.39Å; E64-Y299 WeakPolarHBondContact CG-OH 3.41Å; E64-Y299 PolarHBondContact OE1-OH 3.4Å; E64-T350 WeakPolarHBondContact OE1-CG2 3.47Å; E64-T350 PolarHBondContact OE1-OG1 3.15Å
65	G	84.4	Confident	76.2	Confident	3 Å²	3	53.3 Å²	53.3	3%	0.031	31%	0.307	C	S	.	.			trans	86.1	-171.4	-176.7	0	0	0	0	0	114.2	Q62 L67	Q62-G65 PolarHBondContact O-N 3.04Å; G65-L67 PolarHBondContact O-N 3.35Å
66	C	77.2	Confident	74.9	Confident	8 Å²	8	53.6 Å²	53.6	5%	0.054	31%	0.306	C	S	.	.	B	Isolated β-bridge	trans	-74.2	87.9	-178.3	-77.9	0	0	0	0	112.5	R23 Q35 P37 Q62	R23-C66 HydrophobicContact CB-CB 4.4Å; Q35-C66 HydrophobicContact CB-CB 4.13Å; Q35-C66 WeakPolarHBondContact O-CB 3.48Å; Q35-C66 PolarHBondContact O-N 3.49Å; P37-C66 VanDerWaalsContact CA-SG 3.5Å; Q62-C66 PolarHBondContact OE1-SG 3.37Å
67	L	80	Confident	74.1	Confident	61 Å²	61	52.5 Å²	52.5	32%	0.319	31%	0.314	S	S	.	.			trans	-69.7	136.9	172.3	-57.7	-179.7	0	0	0	111.4	G65 F102 L145	G65-L67 PolarHBondContact O-N 3.35Å; L67-F102 HydrophobicContact CB-CE1 4.28Å; L67-F102 HydrophobicContact CB-CZ 4.27Å; L67-L145 HydrophobicContact CB-CB 4.35Å; L67-L145 HydrophobicContact CB-CD2 4.33Å; L67-L145 HydrophobicContact CG-CD2 4.43Å; L67-L145 WeakPolarHBondContact O-CB 3.47Å; L67-L145 PolarHBondContact O-N 2.81Å
68	S	72.3	Confident	73.9	Confident	58 Å²	58	55.6 Å²	55.6	41%	0.406	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	135.2	171.4	79.2	0	0	0	0	110.7	Q142 S143	S68-Q142 PolarHBondContact OG-NE2 3.38Å; S68-S143 CarbonylContact C-O 3.6Å; S68-S143 VanDerWaalsContact CA-O 3.32Å; S68-S143 WeakPolarHBondContact CA-O 3.28Å
69	S	68.4	Low	73.8	Confident	33 Å²	33	58.8 Å²	58.8	23%	0.231	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	139.6	-179.2	-176.5	0	0	0	0	111	L71 S143	S69-L71 PolarHBondContact OG-N 3.27Å; S69-S143 PolarHBondContact N-O 3.46Å; S69-S143 PolarHBondContact O-N 3.1Å
70	T	57.6	Low	73.9	Confident	120 Å²	120	57.9 Å²	57.9	74%	0.736	35%	0.351	S	S	*	.			trans	-97	-4.2	173.6	51.9	0	0	0	0	113
71	L	52.9	Low	74	Confident	131 Å²	131	56.9 Å²	56.9	69%	0.686	35%	0.347	S	S	*	.	S	Bend	trans	-82.7	146.1	175.2	-106.6	68.5	0	0	0	111.6	S69 S73	S69-L71 PolarHBondContact OG-N 3.27Å; L71-S73 PolarHBondContact O-N 3.05Å; L71-S73 VanDerWaalsContact O-N 3.17Å
72	S	49.1	Very low	74.1	Confident	108 Å²	108	56.9 Å²	56.9	76%	0.755	35%	0.347	S	S	*	.			trans	-58.7	118.6	-176.8	53.7	0	0	0	0	112	T74	S72-T74 VanDerWaalsContact C-N 3.27Å; S72-T74 PolarHBondContact O-N 3.24Å
73	S	46.9	Very low	74.2	Confident	23 Å²	23	56.9 Å²	56.9	16%	0.161	35%	0.347	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.2	23.2	-152.7	-163.4	0	0	0	0	117.3	L71 S143	L71-S73 PolarHBondContact O-N 3.05Å; L71-S73 VanDerWaalsContact O-N 3.17Å; S73-S143 WeakPolarHBondContact CB-OG 3.09Å; S73-S143 WeakPolarHBondContact OG-CB 3.47Å; S73-S143 PolarHBondContact OG-OG 2.92Å
74	T	46.3	Very low	74.4	Confident	118 Å²	118	57.9 Å²	57.9	72%	0.724	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.4	-16.6	-171.1	54.2	0	0	0	0	114.8	S72	S72-T74 VanDerWaalsContact C-N 3.27Å; S72-T74 PolarHBondContact O-N 3.24Å
75	N	48.4	Very low	74.5	Confident	148 Å²	148	57 Å²	57	79%	0.791	35%	0.35	S	S	*	.	S	Bend	trans	-113.9	-0.5	-171.1	-72.8	20.8	0	0	0	115.4	G77	N75-G77 PolarHBondContact O-N 3.45Å
76	M	60.7	Low	74.6	Confident	117 Å²	117	60.6 Å²	60.6	58%	0.576	37%	0.371	S	S	*	.			trans	-89.2	90.5	174.1	-57.7	-58.8	-99.3	0	0	108.8	F102	M76-F102 HydrophobicContact CB-CD2 3.67Å; M76-F102 HydrophobicContact CB-CE2 4.15Å; M76-F102 HydrophobicContact CB-CG 4.48Å; M76-F102 HydrophobicContact CG-CD2 4.39Å
77	G	72.3	Confident	74.9	Confident	59 Å²	59	62.5 Å²	62.5	61%	0.608	38%	0.381	S	S	*	.			trans	-61.3	169.3	-176.3	0	0	0	0	0	114.4	N75	N75-G77 PolarHBondContact O-N 3.45Å
78	T	87.8	Confident	74.7	Confident	65 Å²	65	66.1 Å²	66.1	40%	0.399	39%	0.394	S	S	.	.			trans	-75.3	133	176.8	59.7	0	0	0	0	111.2	L99 N100 F101 K168	T78-L99 HydrophobicContact CG2-CD1 4.47Å; T78-N100 WeakPolarHBondContact CA-O 3.39Å; T78-F101 HydrophobicContact CG2-CB 4.02Å; T78-K168 HydrophobicContact CG2-CD 4.13Å
79	T	92.3	Very high	74.8	Confident	76 Å²	76	69.8 Å²	69.8	47%	0.466	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	146.6	173.6	59.5	0	0	0	0	110.9	N100	T79-N100 PolarHBondContact N-O 2.58Å; T79-N100 PolarHBondContact O-N 3.46Å
80	T	95.1	Very high	75.2	Confident	22 Å²	22	70.8 Å²	70.8	14%	0.135	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	132.9	-178.2	53.6	0	0	0	0	111.1	C98 L99 R161 N300	T80-C98 VanDerWaalsContact CA-O 3.22Å; T80-C98 WeakPolarHBondContact CA-O 3.45Å; T80-L99 HydrophobicContact CG2-CB 4.17Å; T80-L99 HydrophobicContact CG2-CD1 3.45Å; T80-L99 VanDerWaalsContact CG2-CD1 3.45Å; T80-L99 HydrophobicContact CG2-CG 4.38Å; T80-R161 HydrophobicContact CG2-CG 3.94Å; T80-R161 WeakPolarHBondContact OG1-CD 3.31Å; T80-R161 VanDerWaalsContact OG1-CZ 3.27Å; T80-R161 PolarHBondContact OG1-NE 3.48Å; T80-R161 PolarHBondContact OG1-NH1 2.96Å; T80-N300 VanDerWaalsContact O-CB 3.27Å; T80-N300 WeakPolarHBondContact O-CB 3.32Å; T80-N300 PolarHBondContact O-OD1 2.93Å
81	F	96.2	Very high	76	Confident	1 Å²	1	70.3 Å²	70.3	0%	0.004	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150	174.5	178.7	60.7	-85.7	0	0	0	110.5	F60 F83 C98 Y299 N300 L325	F60-F81 VanDerWaalsContact O-CE2 3.22Å; F60-F81 WeakPolarHBondContact O-CE2 3.44Å; F60-F81 WeakPolarHBondContact O-CZ 3.25Å; F81-F83 HydrophobicContact CE2-CD1 4.19Å; F81-C98 HydrophobicContact CD2-CB 4.46Å; F81-C98 HydrophobicContact CE1-CB 4.1Å; F81-C98 HydrophobicContact CE2-CB 4.05Å; F81-C98 HydrophobicContact CZ-CB 3.85Å; F81-C98 PolarHBondContact N-O 2.61Å; F81-C98 VanDerWaalsContact N-O 3.11Å; F81-C98 PolarHBondContact O-N 2.96Å; F81-Y299 HydrophobicContact CD1-CD2 4.05Å; F81-Y299 HydrophobicContact CE1-CD2 4.01Å; F81-Y299 HydrophobicContact CZ-CD2 4.42Å; F81-N300 HydrophobicContact CB-CB 4.28Å; F81-L325 HydrophobicContact CD2-CD2 3.91Å; F81-L325 HydrophobicContact CE2-CD2 3.66Å
82	V	96.6	Very high	77.5	Confident	0 Å²	0	67.2 Å²	67.2	0%	0	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	146.2	-177.7	177.9	0	0	0	0	109.6	G96 I97 F157 T303 M304 M307	V82-G96 CarbonylContact C-O 2.94Å; V82-G96 VanDerWaalsContact CA-O 3.27Å; V82-G96 WeakPolarHBondContact CA-O 3.42Å; V82-I97 HydrophobicContact CG2-CG1 4.26Å; V82-I97 HydrophobicContact CG2-CG2 4.47Å; V82-F157 HydrophobicContact CG1-CD1 3.95Å; V82-F157 HydrophobicContact CG1-CD2 4.17Å; V82-F157 HydrophobicContact CG1-CE1 3.82Å; V82-F157 HydrophobicContact CG1-CE2 4.02Å; V82-F157 HydrophobicContact CG1-CG 4.15Å; V82-F157 HydrophobicContact CG1-CZ 3.86Å; V82-F157 HydrophobicContact CG2-CB 3.98Å; V82-F157 HydrophobicContact CG2-CD1 4.28Å; V82-F157 HydrophobicContact CG2-CD2 4.15Å; V82-F157 HydrophobicContact CG2-CG 3.89Å; V82-T303 WeakPolarHBondContact O-CB 3.21Å; V82-T303 WeakPolarHBondContact O-CG2 3.26Å; V82-T303 PolarHBondContact O-OG1 3.02Å; V82-M304 HydrophobicContact CB-CE 4.16Å; V82-M304 HydrophobicContact CG2-CE 3.55Å; V82-M307 HydrophobicContact CB-CE 4.25Å; V82-M307 HydrophobicContact CG1-CE 4.17Å
83	F	95.5	Very high	79.4	Confident	1 Å²	1	64.1 Å²	64.1	0%	0.004	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	162.7	171	61	-96.5	0	0	0	110.5	V57 F60 F81 L85 G96 C98 I151	V57-F83 HydrophobicContact CG2-CE2 3.98Å; V57-F83 HydrophobicContact CG2-CZ 3.75Å; F60-F83 HydrophobicContact CB-CB 4.22Å; F60-F83 HydrophobicContact CB-CD1 3.77Å; F60-F83 HydrophobicContact CB-CD2 3.56Å; F60-F83 HydrophobicContact CB-CE1 3.92Å; F60-F83 HydrophobicContact CB-CE2 3.73Å; F60-F83 HydrophobicContact CB-CG 3.59Å; F60-F83 HydrophobicContact CB-CZ 3.9Å; F60-F83 HydrophobicContact CD1-CB 4.1Å; F60-F83 HydrophobicContact CD1-CD2 4.2Å; F60-F83 HydrophobicContact CD1-CG 4.27Å; F60-F83 HydrophobicContact CG-CD2 4.02Å; F60-F83 HydrophobicContact CG-CE2 4.41Å; F60-F83 HydrophobicContact CG-CG 4.28Å; F81-F83 HydrophobicContact CE2-CD1 4.19Å; F83-L85 HydrophobicContact CD2-CD2 4.43Å; F83-L85 HydrophobicContact CD2-CG 4.08Å; F83-L85 HydrophobicContact CE2-CD1 4.02Å; F83-L85 HydrophobicContact CE2-CG 4.06Å; F83-G96 PolarHBondContact N-O 2.88Å; F83-G96 PolarHBondContact O-N 2.81Å; F83-C98 HydrophobicContact CE1-CB 4.22Å; F83-I151 HydrophobicContact CE2-CD1 4.38Å; F83-I151 HydrophobicContact CZ-CD1 4.15Å
84	T	93.7	Very high	81.6	Confident	23 Å²	23	63.7 Å²	63.7	14%	0.141	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	141.1	174.8	53.3	0	0	0	0	110.5	T93 R94 F95 P324	T84-T93 HydrophobicContact CG2-CG2 4.2Å; T84-R94 WeakPolarHBondContact CA-O 3.46Å; T84-F95 HydrophobicContact CG2-CD1 3.68Å; T84-F95 HydrophobicContact CG2-CE1 3.81Å; T84-P324 HydrophobicContact CG2-CG 4.32Å; T84-P324 WeakPolarHBondContact OG1-CD 3.5Å; T84-P324 WeakPolarHBondContact OG1-CG 3.45Å
85	L	91.1	Very high	84	Confident	22 Å²	22	59.8 Å²	59.8	12%	0.115	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	112.5	170.5	-59	175.7	0	0	0	107.9	P54 V57 F60 F83 R94	P54-L85 HydrophobicContact CG-CD1 4.27Å; V57-L85 HydrophobicContact CB-CD1 4.22Å; V57-L85 HydrophobicContact CG2-CD1 4.28Å; F60-L85 HydrophobicContact CD1-CD2 4.13Å; F60-L85 HydrophobicContact CD2-CD2 3.64Å; F60-L85 HydrophobicContact CE1-CD2 3.94Å; F60-L85 HydrophobicContact CE2-CD2 3.46Å; F60-L85 VanDerWaalsContact CE2-CD2 3.46Å; F60-L85 HydrophobicContact CG-CD2 3.99Å; F60-L85 HydrophobicContact CZ-CD2 3.61Å; F83-L85 HydrophobicContact CD2-CD2 4.43Å; F83-L85 HydrophobicContact CD2-CG 4.08Å; F83-L85 HydrophobicContact CE2-CD1 4.02Å; F83-L85 HydrophobicContact CE2-CG 4.06Å; L85-R94 HydrophobicContact CB-CB 4.26Å; L85-R94 PolarHBondContact N-O 2.87Å; L85-R94 WeakPolarHBondContact O-CG 3.44Å; L85-R94 PolarHBondContact O-N 2.83Å
86	T	86.7	Confident	86.3	Confident	79 Å²	79	52.7 Å²	52.7	49%	0.485	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	129.4	179.1	-50.4	0	0	0	0	109.6
87	D	82.4	Confident	88	Confident	47 Å²	47	47.1 Å²	47.1	25%	0.251	27%	0.266	S	S	.	.			trans	-68	135.5	172.4	-136.8	-45.1	0	0	0	111.1	S90 Q91 K92 R94	D87-S90 WeakPolarHBondContact CB-OG 3.45Å; D87-S90 PolarHBondContact OD2-OG 2.89Å; D87-Q91 WeakPolarHBondContact O-CA 3.5Å; D87-Q91 PolarHBondContact O-N 3.08Å; D87-K92 HydrophobicContact CB-CB 4.41Å; D87-K92 PolarHBondContact N-O 3.25Å; D87-R94 IonicContact OD2-CZ 2.67Å; D87-R94 IonicContact OD2-NH1 3.52Å; D87-R94 PolarHBondContact OD2-NH1 2.77Å; D87-R94 IonicContact OD2-NH2 3.57Å; D87-R94 PolarHBondContact OD2-NH2 3.27Å
88	K	75.5	Confident	89.2	Confident	138 Å²	138	44.4 Å²	44.4	60%	0.6	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.6	-48.8	177.8	-169.6	-163.4	-177.4	-166.5	0	110	D689	K88-D689 IonicContact NZ-OD1 2.65Å; K88-D689 PolarHBondContact NZ-OD1 2.78Å; K88-D689 IonicContact NZ-OD2 3.9Å; K88-D689 PolarHBondContact NZ-OD2 2.79Å
89	D	75.6	Confident	89.6	Confident	135 Å²	135	41.3 Å²	41.3	72%	0.722	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	-89.1	-47.4	-166.4	-45.9	-34.6	0	0	0	111	Q91	D89-Q91 VanDerWaalsContact C-N 3.35Å; D89-Q91 PolarHBondContact O-N 2.83Å
90	S	77.3	Confident	89.7	Confident	54 Å²	54	37.9 Å²	37.9	38%	0.378	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.7	-7	-176.6	74.9	0	0	0	0	114.6	D87 K92	D87-S90 WeakPolarHBondContact CB-OG 3.45Å; D87-S90 PolarHBondContact OD2-OG 2.89Å; S90-K92 PolarHBondContact O-N 2.94Å; S90-K92 WeakPolarHBondContact OG-CG 3.41Å
91	Q	74.5	Confident	89.6	Confident	110 Å²	110	37.2 Å²	37.2	51%	0.514	19%	0.192	S	C	.	.			trans	51.9	15.1	-171.3	-60	-175.9	36.8	0	0	114.6	M1 D87 D89 T93	M1-Q91 VanDerWaalsContact CA-OE1 3.3Å; D87-Q91 WeakPolarHBondContact O-CA 3.5Å; D87-Q91 PolarHBondContact O-N 3.08Å; D89-Q91 VanDerWaalsContact C-N 3.35Å; D89-Q91 PolarHBondContact O-N 2.83Å; Q91-T93 PolarHBondContact O-N 3.05Å
92	K	83.8	Confident	89.2	Confident	66 Å²	66	39.3 Å²	39.3	29%	0.287	20%	0.201	S	C	.	.			trans	-74.5	114.1	179.1	-67.9	-173.3	-174.8	-167.3	0	110.8	D50 F51 D87 S90 R94	D50-K92 PolarHBondContact O-NZ 2.95Å; F51-K92 HydrophobicContact CD2-CD 4.25Å; D87-K92 HydrophobicContact CB-CB 4.41Å; D87-K92 PolarHBondContact N-O 3.25Å; S90-K92 PolarHBondContact O-N 2.94Å; S90-K92 WeakPolarHBondContact OG-CG 3.41Å; K92-R94 PolarHBondContact O-NH1 2.94Å
93	T	89.1	Confident	88.5	Confident	42 Å²	42	40.6 Å²	40.6	26%	0.258	21%	0.206	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	130.2	169.6	-51.6	0	0	0	0	110.2	T84 Q91 F95	T84-T93 HydrophobicContact CG2-CG2 4.2Å; Q91-T93 PolarHBondContact O-N 3.05Å; T93-F95 HydrophobicContact CG2-CD1 4.44Å; T93-F95 HydrophobicContact CG2-CE1 3.96Å; T93-F95 HydrophobicContact CG2-CE2 4.11Å; T93-F95 HydrophobicContact CG2-CZ 3.78Å
94	R	92.8	Very high	87.6	Confident	15 Å²	15	44.4 Å²	44.4	6%	0.057	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	122.2	171.7	-40	-176.5	166.8	50.4	-8.9	108	F51 V52 T84 L85 D87 K92 I151	F51-R94 HydrophobicContact CE1-CG 4.36Å; F51-R94 HydrophobicContact CE2-CB 4.36Å; F51-R94 HydrophobicContact CE2-CG 3.62Å; F51-R94 HydrophobicContact CZ-CB 3.77Å; F51-R94 HydrophobicContact CZ-CG 3.49Å; F51-R94 VanDerWaalsContact CZ-CG 3.49Å; V52-R94 PolarHBondContact O-NE 2.98Å; V52-R94 PolarHBondContact O-NH2 3.1Å; V52-R94 VanDerWaalsContact O-NH2 3.11Å; T84-R94 WeakPolarHBondContact CA-O 3.46Å; L85-R94 HydrophobicContact CB-CB 4.26Å; L85-R94 PolarHBondContact N-O 2.87Å; L85-R94 WeakPolarHBondContact O-CG 3.44Å; L85-R94 PolarHBondContact O-N 2.83Å; D87-R94 IonicContact OD2-CZ 2.67Å; D87-R94 IonicContact OD2-NH1 3.52Å; D87-R94 PolarHBondContact OD2-NH1 2.77Å; D87-R94 IonicContact OD2-NH2 3.57Å; D87-R94 PolarHBondContact OD2-NH2 3.27Å; K92-R94 PolarHBondContact O-NH1 2.94Å; R94-I151 HydrophobicContact CB-CG2 4.05Å
95	F	95.8	Very high	86.3	Confident	35 Å²	35	44.6 Å²	44.6	15%	0.154	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	119.6	175.4	-62.5	-77.5	0	0	0	109.6	T84 T93 I97 I151 S152 H153 P155 F157	T84-F95 HydrophobicContact CG2-CD1 3.68Å; T84-F95 HydrophobicContact CG2-CE1 3.81Å; T93-F95 HydrophobicContact CG2-CD1 4.44Å; T93-F95 HydrophobicContact CG2-CE1 3.96Å; T93-F95 HydrophobicContact CG2-CE2 4.11Å; T93-F95 HydrophobicContact CG2-CZ 3.78Å; F95-I97 HydrophobicContact CB-CD1 4.44Å; F95-I151 WeakPolarHBondContact O-CA 3.18Å; F95-S152 PolarHBondContact N-O 2.86Å; F95-S152 PolarHBondContact O-N 3.19Å; F95-H153 WeakPolarHBondContact CD2-O 3.4Å; F95-H153 WeakPolarHBondContact CE2-O 3.2Å; F95-P155 HydrophobicContact CD1-CB 4.39Å; F95-P155 HydrophobicContact CD2-CB 4.33Å; F95-P155 HydrophobicContact CE1-CB 4.19Å; F95-P155 HydrophobicContact CE2-CB 4.13Å; F95-P155 HydrophobicContact CG-CB 4.45Å; F95-P155 HydrophobicContact CZ-CB 4.06Å; F95-F157 HydrophobicContact CB-CE1 3.87Å; F95-F157 AromaticContact CD1-CE1 3.51Å; F95-F157 HydrophobicContact CD1-CE1 3.51Å; F95-F157 AromaticContact CD1-CZ 3.54Å; F95-F157 HydrophobicContact CD1-CZ 3.54Å; F95-F157 HydrophobicContact CE1-CE1 4.28Å; F95-F157 AromaticContact CE1-CZ 3.95Å; F95-F157 HydrophobicContact CE1-CZ 3.95Å; F95-F157 AromaticContact CG-CE1 3.82Å; F95-F157 HydrophobicContact CG-CE1 3.82Å; F95-F157 HydrophobicContact CG-CZ 4.31Å
96	G	96.7	Very high	84.7	Confident	0 Å²	0	46.2 Å²	46.2	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	120.3	176	0	0	0	0	0	111.4	V82 F83 L150	V82-G96 CarbonylContact C-O 2.94Å; V82-G96 VanDerWaalsContact CA-O 3.27Å; V82-G96 WeakPolarHBondContact CA-O 3.42Å; F83-G96 PolarHBondContact N-O 2.88Å; F83-G96 PolarHBondContact O-N 2.81Å; G96-L150 WeakPolarHBondContact CA-O 3.4Å
97	I	97.7	Very high	82.9	Confident	0 Å²	0	46.1 Å²	46.1	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	117.7	177	-57.7	79.6	0	0	0	106.4	V82 F95 C149 L150 F157 F160 R161 L164	V82-I97 HydrophobicContact CG2-CG1 4.26Å; V82-I97 HydrophobicContact CG2-CG2 4.47Å; F95-I97 HydrophobicContact CB-CD1 4.44Å; I97-C149 CarbonylContact O-C 3.52Å; I97-C149 VanDerWaalsContact O-CA 3.23Å; I97-C149 WeakPolarHBondContact O-CA 3.47Å; I97-C149 PolarHBondContact O-SG 2.66Å; I97-C149 VanDerWaalsContact O-SG 3.33Å; I97-L150 PolarHBondContact N-O 3.41Å; I97-L150 PolarHBondContact O-N 2.73Å; I97-F157 HydrophobicContact CD1-CD1 4.21Å; I97-F157 HydrophobicContact CG1-CD1 4.09Å; I97-F160 HydrophobicContact CB-CB 4.45Å; I97-F160 HydrophobicContact CD1-CB 4.22Å; I97-F160 HydrophobicContact CD1-CD2 3.7Å; I97-F160 HydrophobicContact CD1-CG 4.44Å; I97-F160 HydrophobicContact CG1-CB 4.07Å; I97-F160 HydrophobicContact CG1-CD2 4.37Å; I97-R161 HydrophobicContact CG2-CB 4.34Å; I97-L164 HydrophobicContact CG2-CD1 4.15Å; I97-L164 WeakPolarHBondContact O-CD1 3.34Å
98	C	97.3	Very high	80.9	Confident	1 Å²	1	50.3 Å²	50.3	1%	0.007	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	138.8	-173.1	-157.6	0	0	0	0	112	T80 F81 F83 N100 L148	T80-C98 VanDerWaalsContact CA-O 3.22Å; T80-C98 WeakPolarHBondContact CA-O 3.45Å; F81-C98 HydrophobicContact CD2-CB 4.46Å; F81-C98 HydrophobicContact CE1-CB 4.1Å; F81-C98 HydrophobicContact CE2-CB 4.05Å; F81-C98 HydrophobicContact CZ-CB 3.85Å; F81-C98 PolarHBondContact N-O 2.61Å; F81-C98 VanDerWaalsContact N-O 3.11Å; F81-C98 PolarHBondContact O-N 2.96Å; F83-C98 HydrophobicContact CE1-CB 4.22Å; C98-N100 PolarHBondContact SG-OD1 3.08Å; C98-L148 CarbonylContact C-O 3.48Å; C98-L148 WeakPolarHBondContact CA-O 3.02Å
99	L	96.7	Very high	78.9	Confident	0 Å²	0	51.6 Å²	51.6	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	108.2	172.8	169.3	61.1	0	0	0	108.7	T78 T80 F101 S147 L148 L164 K168	T78-L99 HydrophobicContact CG2-CD1 4.47Å; T80-L99 HydrophobicContact CG2-CB 4.17Å; T80-L99 HydrophobicContact CG2-CD1 3.45Å; T80-L99 VanDerWaalsContact CG2-CD1 3.45Å; T80-L99 HydrophobicContact CG2-CG 4.38Å; L99-F101 HydrophobicContact CG-CD1 4.36Å; L99-S147 WeakPolarHBondContact O-CA 3.29Å; L99-L148 HydrophobicContact CB-CB 4.43Å; L99-L148 HydrophobicContact CD2-CD1 4.35Å; L99-L148 PolarHBondContact N-O 2.86Å; L99-L148 PolarHBondContact O-N 2.62Å; L99-L164 HydrophobicContact CB-CB 4.23Å; L99-L164 HydrophobicContact CB-CD1 4.11Å; L99-L164 HydrophobicContact CD2-CB 3.9Å; L99-L164 WeakPolarHBondContact CD2-O 3.4Å; L99-K168 HydrophobicContact CD1-CD 4.5Å; L99-K168 HydrophobicContact CD2-CB 3.89Å; L99-K168 HydrophobicContact CD2-CD 3.83Å; L99-K168 HydrophobicContact CD2-CG 4.47Å; L99-K168 HydrophobicContact CG-CD 4.27Å
100	N	94.2	Very high	76.7	Confident	5 Å²	5	49.9 Å²	49.9	3%	0.027	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	136	-177.1	-80.5	7	0	0	0	111.2	C61 T78 T79 C98 L145 S147	C61-N100 PolarHBondContact O-ND2 3.02Å; C61-N100 PolarHBondContact O-OD1 3.2Å; T78-N100 WeakPolarHBondContact CA-O 3.39Å; T79-N100 PolarHBondContact N-O 2.58Å; T79-N100 PolarHBondContact O-N 3.46Å; C98-N100 PolarHBondContact SG-OD1 3.08Å; N100-L145 HydrophobicContact CB-CD1 4.13Å; N100-S147 WeakPolarHBondContact OD1-CB 3.38Å; N100-S147 PolarHBondContact OD1-OG 2.94Å
101	F	92.4	Very high	74.3	Confident	8 Å²	8	51.6 Å²	51.6	4%	0.035	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.2	154.4	178.7	57.1	-82.5	0	0	0	111.5	T78 L99 R103 T146 L148 K168 W192	T78-F101 HydrophobicContact CG2-CB 4.02Å; L99-F101 HydrophobicContact CG-CD1 4.36Å; F101-R103 HydrophobicContact CE2-CB 4.46Å; F101-T146 HydrophobicContact CE2-CG2 4.38Å; F101-T146 HydrophobicContact CZ-CG2 4.04Å; F101-T146 PolarHBondContact N-O 3.23Å; F101-T146 PolarHBondContact O-N 3.25Å; F101-T146 VanDerWaalsContact O-O 3.05Å; F101-L148 HydrophobicContact CE1-CD1 3.99Å; F101-L148 HydrophobicContact CE1-CG 3.91Å; F101-L148 HydrophobicContact CZ-CD1 4.36Å; F101-L148 HydrophobicContact CZ-CG 4.3Å; F101-K168 HydrophobicContact CD1-CD 3.78Å; F101-K168 HydrophobicContact CD2-CD 4.49Å; F101-K168 HydrophobicContact CE1-CD 4.07Å; F101-K168 HydrophobicContact CG-CD 4.03Å; F101-W192 HydrophobicContact CE1-CH2 4.4Å; F101-W192 AromaticContact CE2-CH2 3.71Å; F101-W192 HydrophobicContact CE2-CH2 3.71Å; F101-W192 AromaticContact CE2-CZ2 3.65Å; F101-W192 HydrophobicContact CE2-CZ2 3.65Å; F101-W192 HydrophobicContact CE2-CZ3 4.16Å; F101-W192 AromaticContact CZ-CH2 3.35Å; F101-W192 HydrophobicContact CZ-CH2 3.35Å; F101-W192 AromaticContact CZ-CZ2 3.78Å; F101-W192 HydrophobicContact CZ-CZ2 3.78Å; F101-W192 AromaticContact CZ-CZ3 3.77Å; F101-W192 HydrophobicContact CZ-CZ3 3.77Å
102	F	88	Confident	72	Confident	45 Å²	45	52.8 Å²	52.8	20%	0.197	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	127.8	172.7	-72.1	-86.5	0	0	0	110.2	L67 M76 L145	L67-F102 HydrophobicContact CB-CE1 4.28Å; L67-F102 HydrophobicContact CB-CZ 4.27Å; M76-F102 HydrophobicContact CB-CD2 3.67Å; M76-F102 HydrophobicContact CB-CE2 4.15Å; M76-F102 HydrophobicContact CB-CG 4.48Å; M76-F102 HydrophobicContact CG-CD2 4.39Å; F102-L145 HydrophobicContact CD1-CB 4.3Å; F102-L145 HydrophobicContact CD2-CD1 4.39Å; F102-L145 HydrophobicContact CE1-CB 3.87Å; F102-L145 HydrophobicContact CE1-CD1 4.34Å; F102-L145 HydrophobicContact CE2-CD1 4.05Å; F102-L145 HydrophobicContact CZ-CB 4.26Å; F102-L145 HydrophobicContact CZ-CD1 4.02Å
103	R	82.7	Confident	69.3	Low	27 Å²	27	54.7 Å²	54.7	10%	0.102	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	146.3	170.2	72.3	-179.6	-179.1	95.2	0.1	110.5	F101 S143 I144 T146	F101-R103 HydrophobicContact CE2-CB 4.46Å; R103-S143 CarbonylContact O-C 3.59Å; R103-S143 VanDerWaalsContact O-CA 3.31Å; R103-S143 WeakPolarHBondContact O-CA 3.42Å; R103-I144 PolarHBondContact N-O 2.82Å; R103-I144 VanDerWaalsContact N-O 3.07Å; R103-I144 PolarHBondContact O-N 2.86Å; R103-T146 VanDerWaalsContact CD-OG1 3.29Å; R103-T146 WeakPolarHBondContact CD-OG1 3.36Å; R103-T146 WeakPolarHBondContact CG-OG1 3.49Å; R103-T146 PolarHBondContact NE-OG1 2.83Å
104	Q	75.9	Confident	66.3	Low	81 Å²	81	60.4 Å²	60.4	38%	0.379	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	137	172.2	-65.6	174.9	2.4	0	0	109.9
105	C	66	Low	63.4	Low	27 Å²	27	69.2 Å²	69.2	18%	0.182	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	131.3	173.1	-155.2	0	0	0	0	109.8	Q142 I144	C105-Q142 PolarHBondContact N-O 3.07Å; C105-I144 HydrophobicContact CB-CD1 3.6Å; C105-I144 HydrophobicContact CB-CG1 4.14Å
106	N	57.7	Low	60.4	Low	55 Å²	55	74.5 Å²	74.5	29%	0.294	42%	0.422	S	S	.	.			trans	-81.5	131.4	171.1	-68.1	-21.2	0	0	0	108.3	I108 S188	N106-I108 PolarHBondContact O-N 3.13Å; N106-S188 PolarHBondContact ND2-OG 3.5Å
107	I	49.9	Very low	57.3	Low	77 Å²	77	84.5 Å²	84.5	40%	0.395	47%	0.466	S	S	.	.			trans	-80.6	4.4	-176.1	-69.9	173.2	0	0	0	112.3	Y28 D109 Q142	Y28-I107 WeakPolarHBondContact OH-CG2 3.37Å; I107-D109 PolarHBondContact O-N 2.93Å; I107-D109 VanDerWaalsContact O-N 3.14Å; I107-Q142 HydrophobicContact CD1-CB 4.08Å
108	I	39.4	Very low	54.1	Low	136 Å²	136	94.7 Å²	94.7	70%	0.697	51%	0.51	S	S	*	.			trans	-92.5	73.4	-170.9	-46.1	177.9	0	0	0	111.1	N106	N106-I108 PolarHBondContact O-N 3.13Å
109	D	33.3	Very low	50.9	Low	165 Å²	165	100 Å²	100	88%	0.882	55%	0.547	S	S	*	.			trans	-144.2	37.1	164.7	-98	-35	0	0	0	111.6	I107	I107-D109 PolarHBondContact O-N 2.93Å; I107-D109 VanDerWaalsContact O-N 3.14Å
110	S	29.2	Very low	47.6	Very low	98 Å²	98	111 Å²	111	69%	0.685	59%	0.589	S	S	*	*			trans	-138.1	64.2	175.8	179.5	0	0	0	0	111.7
111	A	27.4	Very low	44.6	Very low	91 Å²	91	122.3 Å²	122.3	75%	0.752	63%	0.632	S	S	*	*			trans	-150.9	40.9	175.2	0	0	0	0	0	113.5
112	C	26.9	Very low	41.6	Very low	135 Å²	135	129.7 Å²	129.7	91%	0.912	67%	0.671	S	S	*	*	S	Bend	trans	-140	39.7	177.2	-91	0	0	0	0	114.2
113	S	26.6	Very low	39.2	Very low	106 Å²	106	132.5 Å²	132.5	74%	0.741	70%	0.696	S	S	*	*	S	Bend	trans	-162.5	88.3	163.1	57.3	0	0	0	0	110.9
114	N	26.5	Very low	36.9	Very low	161 Å²	161	138.7 Å²	138.7	86%	0.861	73%	0.731	S	S	*	*			trans	174.3	80.3	153.9	-90.3	-16.3	0	0	0	110	D116	N114-D116 PolarHBondContact O-N 3.01Å
115	E	31.4	Very low	35	Very low	200 Å²	200	140.8 Å²	140.8	94%	0.935	76%	0.755	S	S	*	*			trans	-75.3	74.5	158.4	-72	-152.8	150.2	0	0	109.5
116	D	32.8	Very low	33.6	Very low	146 Å²	146	145.8 Å²	145.8	78%	0.781	79%	0.785	S	S	*	*			trans	-159.5	22.9	173.9	-111	-23.8	0	0	0	115.9	N114	N114-D116 PolarHBondContact O-N 3.01Å
117	F	31.2	Very low	32.3	Very low	211 Å²	211	151.5 Å²	151.5	93%	0.925	82%	0.815	S	S	*	*			trans	-137.8	41.1	177.9	-109.1	-82.8	0	0	0	115.1
118	K	30.2	Very low	31.6	Very low	213 Å²	213	151.2 Å²	151.2	93%	0.926	83%	0.831	S	S	*	*			trans	-115.4	49.2	179.7	-152.6	175.9	-172.5	175.8	0	113.8
119	S	29.8	Very low	31.3	Very low	112 Å²	112	153.2 Å²	153.2	78%	0.783	84%	0.843	S	S	*	*			trans	-153.2	58.8	175.9	68.9	0	0	0	0	115.1
120	R	28.8	Very low	31.3	Very low	233 Å²	233	149.4 Å²	149.4	88%	0.879	83%	0.834	S	S	*	*			trans	-159.8	132.9	154.1	-125.4	168.5	173.5	136.6	-3.6	111.9
121	W	30.4	Very low	31.5	Very low	242 Å²	242	149.3 Å²	149.3	92%	0.917	83%	0.834	S	S	*	*			trans	113.4	44.8	169.2	-57.3	7.2	0	0	0	116.7
122	D	30.2	Very low	31.8	Very low	162 Å²	162	155.5 Å²	155.5	87%	0.866	84%	0.844	S	S	*	*			trans	-88.3	113.7	145.8	-81.9	-43.8	0	0	0	109.6
123	S	37	Very low	31.9	Very low	104 Å²	104	155.2 Å²	155.2	73%	0.727	83%	0.833	S	S	*	*			trans	170.8	114.3	137.6	-78.8	0	0	0	0	113.3
124	N	34.3	Very low	32.2	Very low	157 Å²	157	158.4 Å²	158.4	84%	0.84	84%	0.836	S	S	*	*			trans	62.3	99.5	143.2	-54.7	-21.3	0	0	0	120.4
125	S	36.5	Very low	32.6	Very low	126 Å²	126	158.5 Å²	158.5	88%	0.881	84%	0.835	S	S	*	*				-154.4	152.8	113.9	58.1	0	0	0	0	110.8
126	T	35.5	Very low	32.6	Very low	132 Å²	132	155.4 Å²	155.4	81%	0.81	82%	0.824	S	S	*	*			trans	-119	140.9	-169.9	-41.9	0	0	0	0	110.9
127	L	30.7	Very low	32.8	Very low	175 Å²	175	153.7 Å²	153.7	92%	0.916	82%	0.819	S	S	*	*			trans	72.5	111.6	160.2	-144.2	74.8	0	0	0	118.4
128	G	35.1	Very low	32.9	Very low	71 Å²	71	149.3 Å²	149.3	73%	0.732	81%	0.805	S	S	*	*			trans	-174.5	92.8	166.1	0	0	0	0	0	111.2	A130	G128-A130 PolarHBondContact O-N 3.22Å
129	N	32.5	Very low	33.7	Very low	177 Å²	177	143.8 Å²	143.8	95%	0.947	79%	0.785	S	S	*	*			trans	-69.6	112.8	176.5	-84.9	-16.5	0	0	0	110.6
130	A	33.2	Very low	34.7	Very low	85 Å²	85	144 Å²	144	70%	0.702	78%	0.778	S	S	*	*			trans	-145.8	133.5	162.9	0	0	0	0	0	110.1	G128	G128-A130 PolarHBondContact O-N 3.22Å
131	S	34	Very low	36.2	Very low	96 Å²	96	137.5 Å²	137.5	67%	0.671	76%	0.756	S	S	*	*			trans	33.6	114	160.5	48.8	0	0	0	0	118.9	D133	S131-D133 PolarHBondContact O-N 3.21Å; S131-D133 VanDerWaalsContact O-N 3.09Å
132	K	33.5	Very low	38	Very low	222 Å²	222	128.2 Å²	128.2	97%	0.965	72%	0.723	S	S	*	*	S	Bend	trans	-81.6	27.1	174	-137	-177.8	-172.1	-173.7	0	113.2
133	D	29.7	Very low	40.4	Very low	128 Å²	128	120.6 Å²	120.6	68%	0.684	68%	0.682	S	S	*	*			trans	-119.6	146.5	-172.4	-63	-58.5	0	0	0	110.2	S131	S131-D133 PolarHBondContact O-N 3.21Å; S131-D133 VanDerWaalsContact O-N 3.09Å
134	Q	32.8	Very low	42.8	Very low	173 Å²	173	116.5 Å²	116.5	81%	0.808	65%	0.652	S	S	*	*			trans	73.9	57.1	175.2	-49.5	-178.3	6.7	0	0	117.2
135	I	35	Very low	45.4	Very low	163 Å²	163	109.7 Å²	109.7	84%	0.836	62%	0.615	S	S	*	*			trans	-90.1	92.3	133.9	-61.5	179.3	0	0	0	106.5	V137	I135-V137 VanDerWaalsContact C-N 3.31Å; I135-V137 HydrophobicContact CG2-CG2 4.23Å; I135-V137 PolarHBondContact O-N 2.86Å
136	L	31.5	Very low	48.1	Very low	136 Å²	136	103.7 Å²	103.7	71%	0.712	57%	0.574	S	S	*	*			trans	-68.8	92.1	167.1	-91.9	155.3	0	0	0	108.3	N138	L136-N138 VanDerWaalsContact C-N 3.27Å; L136-N138 PolarHBondContact O-N 2.65Å
137	V	37.5	Very low	50.9	Low	109 Å²	109	97.4 Å²	97.4	66%	0.661	54%	0.535	S	S	*	.			trans	-66.1	96.4	157.5	179.6	0	0	0	0	106	I135 D139	I135-V137 VanDerWaalsContact C-N 3.31Å; I135-V137 HydrophobicContact CG2-CG2 4.23Å; I135-V137 PolarHBondContact O-N 2.86Å; V137-D139 PolarHBondContact O-N 3Å
138	N	33.2	Very low	54	Low	120 Å²	120	89.1 Å²	89.1	64%	0.642	49%	0.492	S	S	*	.			trans	-69.4	89.2	169.7	-108.5	19.3	0	0	0	108.1	L136 N140	L136-N138 VanDerWaalsContact C-N 3.27Å; L136-N138 PolarHBondContact O-N 2.65Å; N138-N140 PolarHBondContact O-N 3.46Å
139	D	45.9	Very low	57	Low	96 Å²	96	85.7 Å²	85.7	51%	0.513	46%	0.457	S	S	.	.			trans	-61	74.9	163.9	-112.1	18.5	0	0	0	108.4	V137 K141	V137-D139 PolarHBondContact O-N 3Å; D139-K141 PolarHBondContact O-N 2.96Å; D139-K141 WeakPolarHBondContact OD2-CE 3.35Å; D139-K141 IonicContact OD2-NZ 3.26Å; D139-K141 PolarHBondContact OD2-NZ 2.95Å
140	N	50.7	Low	60.1	Low	117 Å²	117	77.3 Å²	77.3	63%	0.626	41%	0.412	S	S	*	.			trans	-70.8	74.3	176.1	-81.9	1.6	0	0	0	109.5	N138 Q142	N138-N140 PolarHBondContact O-N 3.46Å; N140-Q142 PolarHBondContact O-N 3.02Å
141	K	60.1	Low	63.2	Low	96 Å²	96	73.4 Å²	73.4	42%	0.417	38%	0.379	S	S	.	.			trans	-70	88.9	177.8	-72	172.2	-178.6	156.3	0	109.9	D139	D139-K141 PolarHBondContact O-N 2.96Å; D139-K141 WeakPolarHBondContact OD2-CE 3.35Å; D139-K141 IonicContact OD2-NZ 3.26Å; D139-K141 PolarHBondContact OD2-NZ 2.95Å
142	Q	69.4	Low	66.1	Low	47 Å²	47	68.8 Å²	68.8	22%	0.22	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	136.7	174.2	-168.6	173	12.6	0	0	110	S68 C105 I107 N140	S68-Q142 PolarHBondContact OG-NE2 3.38Å; C105-Q142 PolarHBondContact N-O 3.07Å; I107-Q142 HydrophobicContact CD1-CB 4.08Å; N140-Q142 PolarHBondContact O-N 3.02Å
143	S	80.4	Confident	68.9	Low	2 Å²	2	60.2 Å²	60.2	1%	0.014	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	131.8	175.8	-62.7	0	0	0	0	110.6	S68 S69 S73 R103	S68-S143 CarbonylContact C-O 3.6Å; S68-S143 VanDerWaalsContact CA-O 3.32Å; S68-S143 WeakPolarHBondContact CA-O 3.28Å; S69-S143 PolarHBondContact N-O 3.46Å; S69-S143 PolarHBondContact O-N 3.1Å; S73-S143 WeakPolarHBondContact CB-OG 3.09Å; S73-S143 WeakPolarHBondContact OG-CB 3.47Å; S73-S143 PolarHBondContact OG-OG 2.92Å; R103-S143 CarbonylContact O-C 3.59Å; R103-S143 VanDerWaalsContact O-CA 3.31Å; R103-S143 WeakPolarHBondContact O-CA 3.42Å
144	I	86.3	Confident	72	Confident	18 Å²	18	54.8 Å²	54.8	9%	0.092	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	132.7	-169.9	-55.4	178.9	0	0	0	108.6	R23 R103 C105 T146	R23-I144 HydrophobicContact CB-CG2 4.08Å; R103-I144 PolarHBondContact N-O 2.82Å; R103-I144 VanDerWaalsContact N-O 3.07Å; R103-I144 PolarHBondContact O-N 2.86Å; C105-I144 HydrophobicContact CB-CD1 3.6Å; C105-I144 HydrophobicContact CB-CG1 4.14Å; I144-T146 PolarHBondContact O-N 2.76Å
145	L	90.4	Very high	74.8	Confident	14 Å²	14	47.8 Å²	47.8	7%	0.073	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.5	120	173.1	-174.2	64.1	0	0	0	110.2	Q62 L67 N100 F102	Q62-L145 HydrophobicContact CG-CD2 4.05Å; Q62-L145 HydrophobicContact CG-CG 4.5Å; Q62-L145 PolarHBondContact NE2-O 2.62Å; L67-L145 HydrophobicContact CB-CB 4.35Å; L67-L145 HydrophobicContact CB-CD2 4.33Å; L67-L145 HydrophobicContact CG-CD2 4.43Å; L67-L145 WeakPolarHBondContact O-CB 3.47Å; L67-L145 PolarHBondContact O-N 2.81Å; N100-L145 HydrophobicContact CB-CD1 4.13Å; F102-L145 HydrophobicContact CD1-CB 4.3Å; F102-L145 HydrophobicContact CD2-CD1 4.39Å; F102-L145 HydrophobicContact CE1-CB 3.87Å; F102-L145 HydrophobicContact CE1-CD1 4.34Å; F102-L145 HydrophobicContact CE2-CD1 4.05Å; F102-L145 HydrophobicContact CZ-CB 4.26Å; F102-L145 HydrophobicContact CZ-CD1 4.02Å
146	T	91.8	Very high	77.7	Confident	1 Å²	1	40 Å²	40	1%	0.006	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	143.8	174.5	-56.6	0	0	0	0	108.8	F101 R103 I144	F101-T146 HydrophobicContact CE2-CG2 4.38Å; F101-T146 HydrophobicContact CZ-CG2 4.04Å; F101-T146 PolarHBondContact N-O 3.23Å; F101-T146 PolarHBondContact O-N 3.25Å; F101-T146 VanDerWaalsContact O-O 3.05Å; R103-T146 VanDerWaalsContact CD-OG1 3.29Å; R103-T146 WeakPolarHBondContact CD-OG1 3.36Å; R103-T146 WeakPolarHBondContact CG-OG1 3.49Å; R103-T146 PolarHBondContact NE-OG1 2.83Å; I144-T146 PolarHBondContact O-N 2.76Å
147	S	95.1	Very high	80.8	Confident	0 Å²	0	33.7 Å²	33.7	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	129.6	-174.4	-57.1	0	0	0	0	109.7	F20 V21 C61 Q62 L99 N100	F20-S147 WeakPolarHBondContact CA-O 3.5Å; V21-S147 PolarHBondContact N-O 2.66Å; V21-S147 PolarHBondContact O-N 3.32Å; C61-S147 PolarHBondContact O-OG 2.78Å; Q62-S147 VanDerWaalsContact CG-OG 3.25Å; Q62-S147 WeakPolarHBondContact CG-OG 3.38Å; Q62-S147 PolarHBondContact NE2-OG 3.49Å; L99-S147 WeakPolarHBondContact O-CA 3.29Å; N100-S147 WeakPolarHBondContact OD1-CB 3.38Å; N100-S147 PolarHBondContact OD1-OG 2.94Å
148	L	96.8	Very high	83.4	Confident	0 Å²	0	30.9 Å²	30.9	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	129.6	163.1	-69.3	168	0	0	0	108.1	F20 C98 L99 F101 L164 K168 W192	F20-L148 HydrophobicContact CD1-CD2 3.44Å; F20-L148 VanDerWaalsContact CD1-CD2 3.44Å; F20-L148 HydrophobicContact CD2-CD2 4.25Å; F20-L148 HydrophobicContact CE1-CD2 3.31Å; F20-L148 HydrophobicContact CE2-CD2 4.09Å; F20-L148 HydrophobicContact CG-CD2 3.94Å; F20-L148 HydrophobicContact CZ-CD2 3.65Å; C98-L148 CarbonylContact C-O 3.48Å; C98-L148 WeakPolarHBondContact CA-O 3.02Å; L99-L148 HydrophobicContact CB-CB 4.43Å; L99-L148 HydrophobicContact CD2-CD1 4.35Å; L99-L148 PolarHBondContact N-O 2.86Å; L99-L148 PolarHBondContact O-N 2.62Å; F101-L148 HydrophobicContact CE1-CD1 3.99Å; F101-L148 HydrophobicContact CE1-CG 3.91Å; F101-L148 HydrophobicContact CZ-CD1 4.36Å; F101-L148 HydrophobicContact CZ-CG 4.3Å; L148-L164 HydrophobicContact CB-CD2 3.81Å; L148-K168 HydrophobicContact CD1-CB 3.97Å; L148-W192 HydrophobicContact CD1-CH2 4.42Å
149	C	97.7	Very high	86.4	Confident	0 Å²	0	27.2 Å²	27.2	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	131.7	178.6	-171.2	0	0	0	0	112.3	L18 V19 C61 I97 I151	L18-C149 CarbonylContact C-O 3.56Å; L18-C149 WeakPolarHBondContact CA-O 3.31Å; V19-C149 PolarHBondContact N-O 2.88Å; V19-C149 PolarHBondContact O-N 3.31Å; C61-C149 VanDerWaalsContact SG-CB 3.57Å; I97-C149 CarbonylContact O-C 3.52Å; I97-C149 VanDerWaalsContact O-CA 3.23Å; I97-C149 WeakPolarHBondContact O-CA 3.47Å; I97-C149 PolarHBondContact O-SG 2.66Å; I97-C149 VanDerWaalsContact O-SG 3.33Å; C149-I151 VanDerWaalsContact SG-CD1 3.59Å
150	L	97.8	Very high	88.8	Confident	1 Å²	1	22.7 Å²	22.7	1%	0.005	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	134.8	166.6	-69.5	176.9	0	0	0	109.5	I15 Y17 L18 G96 I97 F160 C163 L164	I15-L150 HydrophobicContact CD1-CD1 4.16Å; I15-L150 HydrophobicContact CD1-CD2 4.37Å; I15-L150 HydrophobicContact CG2-CD2 3.92Å; Y17-L150 WeakPolarHBondContact O-CA 3.46Å; L18-L150 HydrophobicContact CB-CD2 3.84Å; L18-L150 HydrophobicContact CD1-CD2 3.68Å; L18-L150 HydrophobicContact CG-CD2 3.75Å; G96-L150 WeakPolarHBondContact CA-O 3.4Å; I97-L150 PolarHBondContact N-O 3.41Å; I97-L150 PolarHBondContact O-N 2.73Å; L150-F160 HydrophobicContact CD1-CB 3.8Å; L150-F160 HydrophobicContact CD1-CD1 4.37Å; L150-F160 HydrophobicContact CD1-CG 4.23Å; L150-C163 HydrophobicContact CD1-CB 4.26Å; L150-L164 HydrophobicContact CD1-CD1 4.39Å; L150-L164 HydrophobicContact CD1-CD2 4.17Å; L150-L164 HydrophobicContact CD1-CG 3.82Å; L150-L164 HydrophobicContact CD2-CD2 4.32Å; L150-L164 HydrophobicContact CG-CD1 4.14Å; L150-L164 HydrophobicContact CG-CD2 3.74Å; L150-L164 HydrophobicContact CG-CG 3.81Å
151	I	97	Very high	91	Very high	2 Å²	2	19.3 Å²	19.3	1%	0.01	10%	0.095	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	128.1	172.5	-48.1	-62.5	0	0	0	108.9	D16 Y17 V19 F51 L53 V57 F83 R94 F95 C149	D16-I151 PolarHBondContact N-O 2.6Å; Y17-I151 HydrophobicContact CD2-CB 4.32Å; Y17-I151 PolarHBondContact N-O 3.28Å; Y17-I151 VanDerWaalsContact N-O 3.15Å; Y17-I151 PolarHBondContact O-N 3.22Å; V19-I151 HydrophobicContact CG2-CG1 4.38Å; F51-I151 HydrophobicContact CE1-CG2 4.08Å; L53-I151 HydrophobicContact CD1-CG1 3.87Å; V57-I151 HydrophobicContact CG2-CD1 3.75Å; F83-I151 HydrophobicContact CE2-CD1 4.38Å; F83-I151 HydrophobicContact CZ-CD1 4.15Å; R94-I151 HydrophobicContact CB-CG2 4.05Å; F95-I151 WeakPolarHBondContact O-CA 3.18Å; C149-I151 VanDerWaalsContact SG-CD1 3.59Å
152	S	95.5	Very high	92.6	Very high	0 Å²	0	19.3 Å²	19.3	0%	0	10%	0.096	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143	156.1	179.1	-178.6	0	0	0	0	112	L14 D16 F95 H154	L14-S152 PolarHBondContact O-OG 3.32Å; D16-S152 WeakPolarHBondContact OD2-CA 3.02Å; F95-S152 PolarHBondContact N-O 2.86Å; F95-S152 PolarHBondContact O-N 3.19Å; S152-H154 VanDerWaalsContact C-N 3.26Å; S152-H154 PolarHBondContact OG-N 3.25Å
153	H	92.9	Very high	93.9	Very high	41 Å²	41	17.1 Å²	17.1	19%	0.19	9%	0.086	C	C	.	.	S	Bend	trans	-68.8	-20.9	161.9	-68.8	79.9	0	0	0	113.4	C11 D16 F51 F95	C11-H153 HydrophobicContact CB-CB 4.27Å; C11-H153 VanDerWaalsContact SG-CE1 3.58Å; D16-H153 VanDerWaalsContact CG-ND1 3.29Å; D16-H153 IonicContact OD1-CE1 3.59Å; D16-H153 PolarHBondContact OD1-CE1 3.27Å; D16-H153 VanDerWaalsContact OD1-CE1 3.32Å; D16-H153 IonicContact OD1-ND1 2.76Å; D16-H153 PolarHBondContact OD1-ND1 2.75Å; D16-H153 IonicContact OD2-CE1 3.56Å; D16-H153 IonicContact OD2-CG 2.69Å; D16-H153 PolarHBondContact OD2-N 3.24Å; D16-H153 IonicContact OD2-ND1 3.83Å; D16-H153 PolarHBondContact OD2-ND1 3.39Å; F51-H153 AromaticContact CD1-CE1 3.53Å; F51-H153 AromaticContact CD1-ND1 3.92Å; F51-H153 AromaticContact CD2-CE1 3.19Å; F51-H153 WeakPolarHBondContact CD2-CE1 3.39Å; F51-H153 AromaticContact CD2-ND1 3.99Å; F51-H153 AromaticContact CD2-NE2 3.17Å; F51-H153 WeakPolarHBondContact CD2-NE2 3.48Å; F51-H153 AromaticContact CE1-CE1 3.78Å; F51-H153 AromaticContact CE1-ND1 3.75Å; F51-H153 AromaticContact CE2-CD2 3.71Å; F51-H153 AromaticContact CE2-CE1 3.44Å; F51-H153 VanDerWaalsContact CE2-CE1 3.44Å; F51-H153 WeakPolarHBondContact CE2-CE1 3.08Å; F51-H153 AromaticContact CE2-CG 3.97Å; F51-H153 AromaticContact CE2-ND1 3.8Å; F51-H153 AromaticContact CE2-NE2 3.37Å; F51-H153 WeakPolarHBondContact CE2-NE2 3.4Å; F51-H153 AromaticContact CG-CE1 3.2Å; F51-H153 WeakPolarHBondContact CG-CE1 3.36Å; F51-H153 AromaticContact CG-NE2 3.69Å; F51-H153 AromaticContact CZ-CE1 3.71Å; F51-H153 AromaticContact CZ-CG 3.98Å; F51-H153 AromaticContact CZ-ND1 3.66Å; F95-H153 WeakPolarHBondContact CD2-O 3.4Å; F95-H153 WeakPolarHBondContact CE2-O 3.2Å
154	H	93.3	Very high	94.7	Very high	14 Å²	14	17.1 Å²	17.1	7%	0.065	9%	0.086	C	C	.	.	S	Bend	trans	-109	136.4	-166.4	-56.4	-68.2	0	0	0	111.9	Y10 C11 R13 S152 F156 F160 V229	Y10-H154 AromaticContact CE1-CE1 3.94Å; C11-H154 PolarHBondContact O-NE2 2.94Å; R13-H154 PolarHBondContact O-CD2 3.26Å; R13-H154 VanDerWaalsContact O-CD2 3.29Å; R13-H154 PolarHBondContact O-NE2 3.49Å; S152-H154 VanDerWaalsContact C-N 3.26Å; S152-H154 PolarHBondContact OG-N 3.25Å; H154-F156 VanDerWaalsContact C-N 3.3Å; H154-F156 HydrophobicContact CB-CD2 3.8Å; H154-F156 HydrophobicContact CB-CE2 4.01Å; H154-F156 PolarHBondContact O-N 3.29Å; H154-F160 WeakPolarHBondContact O-CE2 3.49Å; H154-V229 WeakPolarHBondContact NE2-CG2 3.47Å
155	P	93.4	Very high	95.1	Very high	27 Å²	27	19.7 Å²	19.7	18%	0.175	10%	0.098	C	C	.	.			trans	-86.6	47.9	-170.7	35.7	-37.8	0	0	0	114.2	F95 F157 L262 D264	F95-P155 HydrophobicContact CD1-CB 4.39Å; F95-P155 HydrophobicContact CD2-CB 4.33Å; F95-P155 HydrophobicContact CE1-CB 4.19Å; F95-P155 HydrophobicContact CE2-CB 4.13Å; F95-P155 HydrophobicContact CG-CB 4.45Å; F95-P155 HydrophobicContact CZ-CB 4.06Å; P155-F157 VanDerWaalsContact C-N 3.28Å; P155-F157 VanDerWaalsContact CA-CE1 3.5Å; P155-F157 HydrophobicContact CB-CD1 4.47Å; P155-F157 HydrophobicContact CB-CE1 3.71Å; P155-F157 HydrophobicContact CB-CZ 3.8Å; P155-F157 PolarHBondContact O-N 3.13Å; P155-F157 VanDerWaalsContact O-N 3.11Å; P155-L262 HydrophobicContact CG-CD2 4.36Å; P155-D264 WeakPolarHBondContact O-CB 3.28Å
156	F	95.4	Very high	95.2	Very high	0 Å²	0	19.8 Å²	19.8	0%	0	10%	0.099	C	C	.	.			trans	-86.5	54.5	179.7	-67.4	-68.7	0	0	0	113.5	L14 H154 S158 K159 F160 P230 F252 A253 L254 L262 D264	L14-F156 HydrophobicContact CD1-CD2 3.93Å; L14-F156 HydrophobicContact CD1-CE2 3.88Å; H154-F156 VanDerWaalsContact C-N 3.3Å; H154-F156 HydrophobicContact CB-CD2 3.8Å; H154-F156 HydrophobicContact CB-CE2 4.01Å; H154-F156 PolarHBondContact O-N 3.29Å; F156-S158 PolarHBondContact O-N 2.83Å; F156-K159 HydrophobicContact CD1-CD 4.3Å; F156-K159 PolarHBondContact O-N 3.04Å; F156-F160 HydrophobicContact CB-CD1 4.42Å; F156-F160 HydrophobicContact CB-CD2 3.95Å; F156-F160 HydrophobicContact CB-CE1 4.2Å; F156-F160 HydrophobicContact CB-CE2 3.73Å; F156-F160 HydrophobicContact CB-CG 4.31Å; F156-F160 HydrophobicContact CB-CZ 3.85Å; F156-F160 HydrophobicContact CD2-CE2 4.43Å; F156-F160 HydrophobicContact CD2-CZ 4.06Å; F156-F160 HydrophobicContact CG-CZ 4.46Å; F156-F160 WeakPolarHBondContact O-CB 3.38Å; F156-F160 VanDerWaalsContact O-CD2 3.3Å; F156-F160 WeakPolarHBondContact O-CD2 3.25Å; F156-F160 VanDerWaalsContact O-CG 3.23Å; F156-F160 WeakPolarHBondContact O-CG 3.4Å; F156-F160 PolarHBondContact O-N 3.33Å; F156-P230 HydrophobicContact CZ-CG 4.21Å; F156-F252 HydrophobicContact CB-CD1 3.96Å; F156-F252 HydrophobicContact CB-CE1 3.88Å; F156-F252 AromaticContact CD1-CD1 3.88Å; F156-F252 HydrophobicContact CD1-CD1 3.88Å; F156-F252 AromaticContact CD2-CD1 3.69Å; F156-F252 HydrophobicContact CD2-CD1 3.69Å; F156-F252 HydrophobicContact CD2-CE1 4.28Å; F156-F252 HydrophobicContact CE1-CB 4.32Å; F156-F252 HydrophobicContact CE1-CD1 4.18Å; F156-F252 HydrophobicContact CE2-CB 4.4Å; F156-F252 HydrophobicContact CE2-CD1 4.01Å; F156-F252 AromaticContact CG-CD1 3.6Å; F156-F252 HydrophobicContact CG-CD1 3.6Å; F156-F252 HydrophobicContact CG-CE1 4.05Å; F156-F252 HydrophobicContact CZ-CB 4.08Å; F156-F252 HydrophobicContact CZ-CD1 4.22Å; F156-A253 WeakPolarHBondContact CE1-O 3.46Å; F156-L254 HydrophobicContact CE1-CD2 4.38Å; F156-L254 HydrophobicContact CE2-CD2 4.22Å; F156-L254 HydrophobicContact CE2-CG 4.37Å; F156-L254 HydrophobicContact CZ-CD1 4.44Å; F156-L254 HydrophobicContact CZ-CD2 3.7Å; F156-L254 HydrophobicContact CZ-CG 3.79Å; F156-L262 HydrophobicContact CD1-CD2 3.76Å; F156-L262 HydrophobicContact CE1-CD2 3.46Å; F156-L262 VanDerWaalsContact CE1-CD2 3.46Å; F156-L262 HydrophobicContact CZ-CD2 4.06Å; F156-D264 VanDerWaalsContact CA-OD2 3.31Å; F156-D264 WeakPolarHBondContact CA-OD2 3.31Å
157	F	95.5	Very high	95.3	Very high	2 Å²	2	19.8 Å²	19.8	1%	0.009	10%	0.099	C	C	.	.	H	α-helix	trans	-56.3	-43.8	-168.8	-52	-24.6	0	0	0	114.4	V82 F95 I97 P155 R161 D264 F265 M304 M307	V82-F157 HydrophobicContact CG1-CD1 3.95Å; V82-F157 HydrophobicContact CG1-CD2 4.17Å; V82-F157 HydrophobicContact CG1-CE1 3.82Å; V82-F157 HydrophobicContact CG1-CE2 4.02Å; V82-F157 HydrophobicContact CG1-CG 4.15Å; V82-F157 HydrophobicContact CG1-CZ 3.86Å; V82-F157 HydrophobicContact CG2-CB 3.98Å; V82-F157 HydrophobicContact CG2-CD1 4.28Å; V82-F157 HydrophobicContact CG2-CD2 4.15Å; V82-F157 HydrophobicContact CG2-CG 3.89Å; F95-F157 HydrophobicContact CB-CE1 3.87Å; F95-F157 AromaticContact CD1-CE1 3.51Å; F95-F157 HydrophobicContact CD1-CE1 3.51Å; F95-F157 AromaticContact CD1-CZ 3.54Å; F95-F157 HydrophobicContact CD1-CZ 3.54Å; F95-F157 HydrophobicContact CE1-CE1 4.28Å; F95-F157 AromaticContact CE1-CZ 3.95Å; F95-F157 HydrophobicContact CE1-CZ 3.95Å; F95-F157 AromaticContact CG-CE1 3.82Å; F95-F157 HydrophobicContact CG-CE1 3.82Å; F95-F157 HydrophobicContact CG-CZ 4.31Å; I97-F157 HydrophobicContact CD1-CD1 4.21Å; I97-F157 HydrophobicContact CG1-CD1 4.09Å; P155-F157 VanDerWaalsContact C-N 3.28Å; P155-F157 VanDerWaalsContact CA-CE1 3.5Å; P155-F157 HydrophobicContact CB-CD1 4.47Å; P155-F157 HydrophobicContact CB-CE1 3.71Å; P155-F157 HydrophobicContact CB-CZ 3.8Å; P155-F157 PolarHBondContact O-N 3.13Å; P155-F157 VanDerWaalsContact O-N 3.11Å; F157-R161 VanDerWaalsContact O-CB 3.23Å; F157-R161 WeakPolarHBondContact O-CB 3.48Å; F157-R161 PolarHBondContact O-N 3.5Å; F157-D264 HydrophobicContact CB-CB 4.49Å; F157-D264 PolarHBondContact N-OD2 3.49Å; F157-F265 HydrophobicContact CD2-CB 4.39Å; F157-F265 AromaticContact CD2-CD1 3.82Å; F157-F265 HydrophobicContact CD2-CD1 3.82Å; F157-F265 AromaticContact CE2-CD1 3.5Å; F157-F265 HydrophobicContact CE2-CD1 3.5Å; F157-F265 VanDerWaalsContact CE2-CD1 3.5Å; F157-F265 AromaticContact CE2-CE1 3.97Å; F157-F265 HydrophobicContact CE2-CE1 3.97Å; F157-M304 HydrophobicContact CD2-CE 4.39Å; F157-M304 HydrophobicContact CD2-SD 4.43Å; F157-M307 HydrophobicContact CD2-CE 4.19Å; F157-M307 HydrophobicContact CE2-CE 3.59Å; F157-M307 HydrophobicContact CE2-SD 3.7Å; F157-M307 HydrophobicContact CZ-CE 4.37Å; F157-M307 HydrophobicContact CZ-SD 4.01Å
158	S	93.6	Very high	95.3	Very high	50 Å²	50	21.2 Å²	21.2	35%	0.35	11%	0.105	S	C	.	.	H	α-helix	trans	-67.5	-42.8	-176.4	-57.9	0	0	0	0	111.1	F156 R161 Q162 D264	F156-S158 PolarHBondContact O-N 2.83Å; S158-R161 WeakPolarHBondContact O-CB 3.37Å; S158-R161 PolarHBondContact O-N 2.97Å; S158-Q162 WeakPolarHBondContact O-CG 3.43Å; S158-Q162 PolarHBondContact O-N 3.39Å; S158-Q162 VanDerWaalsContact O-N 3.07Å; S158-D264 WeakPolarHBondContact CB-OD1 3.19Å; S158-D264 PolarHBondContact N-OD2 3.34Å; S158-D264 PolarHBondContact OG-OD1 2.93Å
159	K	95	Very high	95	Very high	44 Å²	44	24.9 Å²	24.9	19%	0.191	12%	0.123	C	C	.	.	H	α-helix	trans	-75.3	-38	-177.4	-63.1	162.8	-165.5	175.9	0	111.4	F156 Q162 C163 I251 F252	F156-K159 HydrophobicContact CD1-CD 4.3Å; F156-K159 PolarHBondContact O-N 3.04Å; K159-Q162 PolarHBondContact O-N 3.07Å; K159-C163 PolarHBondContact O-N 2.98Å; K159-C163 PolarHBondContact O-SG 2.89Å; K159-I251 WeakPolarHBondContact CD-O 3.12Å; K159-I251 WeakPolarHBondContact CE-O 3.41Å; K159-I251 PolarHBondContact NZ-O 2.96Å; K159-F252 HydrophobicContact CB-CD1 4.28Å; K159-F252 HydrophobicContact CB-CE1 3.48Å; K159-F252 VanDerWaalsContact CB-CE1 3.48Å; K159-F252 HydrophobicContact CB-CE2 4.48Å; K159-F252 HydrophobicContact CB-CZ 3.61Å; K159-F252 HydrophobicContact CD-CD1 3.86Å; K159-F252 HydrophobicContact CD-CE1 3.94Å; K159-F252 HydrophobicContact CD-CG 4.26Å; K159-F252 HydrophobicContact CD-CZ 4.4Å; K159-F252 HydrophobicContact CG-CE1 4.31Å
160	F	97	Very high	94.7	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-66.7	-35.6	172.2	-67.4	-23.6	0	0	0	112.4	L14 I15 I97 L150 H154 F156 C163 L164 F252	L14-F160 HydrophobicContact CD1-CE1 4.34Å; L14-F160 HydrophobicContact CD1-CZ 4.17Å; L14-F160 HydrophobicContact CD2-CE1 4.17Å; L14-F160 HydrophobicContact CG-CE1 3.89Å; L14-F160 HydrophobicContact CG-CZ 3.99Å; L14-F160 WeakPolarHBondContact O-CZ 3.4Å; I15-F160 HydrophobicContact CD1-CD1 3.94Å; I15-F160 HydrophobicContact CD1-CE1 3.74Å; I15-F160 HydrophobicContact CD1-CZ 4.5Å; I15-F160 HydrophobicContact CG1-CD1 4.08Å; I15-F160 HydrophobicContact CG1-CE1 3.49Å; I15-F160 VanDerWaalsContact CG1-CE1 3.49Å; I15-F160 HydrophobicContact CG1-CZ 3.77Å; I97-F160 HydrophobicContact CB-CB 4.45Å; I97-F160 HydrophobicContact CD1-CB 4.22Å; I97-F160 HydrophobicContact CD1-CD2 3.7Å; I97-F160 HydrophobicContact CD1-CG 4.44Å; I97-F160 HydrophobicContact CG1-CB 4.07Å; I97-F160 HydrophobicContact CG1-CD2 4.37Å; L150-F160 HydrophobicContact CD1-CB 3.8Å; L150-F160 HydrophobicContact CD1-CD1 4.37Å; L150-F160 HydrophobicContact CD1-CG 4.23Å; H154-F160 WeakPolarHBondContact O-CE2 3.49Å; F156-F160 HydrophobicContact CB-CD1 4.42Å; F156-F160 HydrophobicContact CB-CD2 3.95Å; F156-F160 HydrophobicContact CB-CE1 4.2Å; F156-F160 HydrophobicContact CB-CE2 3.73Å; F156-F160 HydrophobicContact CB-CG 4.31Å; F156-F160 HydrophobicContact CB-CZ 3.85Å; F156-F160 HydrophobicContact CD2-CE2 4.43Å; F156-F160 HydrophobicContact CD2-CZ 4.06Å; F156-F160 HydrophobicContact CG-CZ 4.46Å; F156-F160 WeakPolarHBondContact O-CB 3.38Å; F156-F160 VanDerWaalsContact O-CD2 3.3Å; F156-F160 WeakPolarHBondContact O-CD2 3.25Å; F156-F160 VanDerWaalsContact O-CG 3.23Å; F156-F160 WeakPolarHBondContact O-CG 3.4Å; F156-F160 PolarHBondContact O-N 3.33Å; F160-C163 WeakPolarHBondContact O-CB 3.17Å; F160-C163 PolarHBondContact O-N 3.46Å; F160-L164 PolarHBondContact O-N 3.45Å; F160-F252 AromaticContact CD1-CE1 3.96Å; F160-F252 HydrophobicContact CD1-CE1 3.96Å; F160-F252 HydrophobicContact CD1-CZ 4.32Å; F160-F252 AromaticContact CE1-CE1 3.61Å; F160-F252 HydrophobicContact CE1-CE1 3.61Å; F160-F252 HydrophobicContact CE1-CZ 4.16Å; F160-F252 HydrophobicContact CZ-CE1 4.37Å
161	R	96.3	Very high	94.4	Very high	47 Å²	47	25.1 Å²	25.1	18%	0.177	12%	0.124	C	C	.	.	H	α-helix	trans	-61.1	-43.8	170.1	-171.6	-177.7	-60.3	-159.1	-3.5	111.5	T80 I97 F157 S158 C163 L164 H165 N300 M304	T80-R161 HydrophobicContact CG2-CG 3.94Å; T80-R161 WeakPolarHBondContact OG1-CD 3.31Å; T80-R161 VanDerWaalsContact OG1-CZ 3.27Å; T80-R161 PolarHBondContact OG1-NE 3.48Å; T80-R161 PolarHBondContact OG1-NH1 2.96Å; I97-R161 HydrophobicContact CG2-CB 4.34Å; F157-R161 VanDerWaalsContact O-CB 3.23Å; F157-R161 WeakPolarHBondContact O-CB 3.48Å; F157-R161 PolarHBondContact O-N 3.5Å; S158-R161 WeakPolarHBondContact O-CB 3.37Å; S158-R161 PolarHBondContact O-N 2.97Å; R161-C163 PolarHBondContact O-N 3.47Å; R161-L164 PolarHBondContact O-N 2.86Å; R161-H165 PolarHBondContact O-CD2 2.94Å; R161-H165 PolarHBondContact O-N 2.83Å; R161-N300 PolarHBondContact NH1-OD1 3.36Å; R161-N300 PolarHBondContact NH2-OD1 3.06Å; R161-M304 VanDerWaalsContact NH2-CE 3.31Å
162	Q	94.9	Very high	94	Very high	95 Å²	95	27.4 Å²	27.4	44%	0.444	14%	0.136	S	C	.	.	H	α-helix	trans	-63.6	-38.1	174.9	-69.2	174.6	21.9	0	0	112.7	S158 K159 H165 S166 L250	S158-Q162 WeakPolarHBondContact O-CG 3.43Å; S158-Q162 PolarHBondContact O-N 3.39Å; S158-Q162 VanDerWaalsContact O-N 3.07Å; K159-Q162 PolarHBondContact O-N 3.07Å; Q162-H165 PolarHBondContact O-N 3.43Å; Q162-S166 WeakPolarHBondContact O-CB 3.41Å; Q162-S166 PolarHBondContact O-N 2.98Å; Q162-S166 PolarHBondContact O-OG 3.47Å; Q162-L250 HydrophobicContact CB-CD1 4.28Å; Q162-L250 HydrophobicContact CB-CD2 4.32Å
163	C	96	Very high	93.7	Very high	1 Å²	1	28.7 Å²	28.7	1%	0.007	14%	0.141	C	C	.	.	H	α-helix	trans	-59.7	-45.9	171.7	-63.2	0	0	0	0	111.7	L150 K159 F160 R161 S166 L167 L224 L250	L150-C163 HydrophobicContact CD1-CB 4.26Å; K159-C163 PolarHBondContact O-N 2.98Å; K159-C163 PolarHBondContact O-SG 2.89Å; F160-C163 WeakPolarHBondContact O-CB 3.17Å; F160-C163 PolarHBondContact O-N 3.46Å; R161-C163 PolarHBondContact O-N 3.47Å; C163-S166 PolarHBondContact O-N 2.83Å; C163-L167 PolarHBondContact O-N 3.2Å; C163-L224 HydrophobicContact CB-CD2 4.25Å; C163-L250 WeakPolarHBondContact SG-CD1 3.43Å
164	L	96.3	Very high	93.5	Very high	3 Å²	3	26.8 Å²	26.8	2%	0.016	13%	0.132	C	C	.	.	H	α-helix	trans	-65.1	-41	178.1	-77.2	179.9	0	0	0	113.2	I97 L99 L148 L150 F160 R161 L167 K168	I97-L164 HydrophobicContact CG2-CD1 4.15Å; I97-L164 WeakPolarHBondContact O-CD1 3.34Å; L99-L164 HydrophobicContact CB-CB 4.23Å; L99-L164 HydrophobicContact CB-CD1 4.11Å; L99-L164 HydrophobicContact CD2-CB 3.9Å; L99-L164 WeakPolarHBondContact CD2-O 3.4Å; L148-L164 HydrophobicContact CB-CD2 3.81Å; L150-L164 HydrophobicContact CD1-CD1 4.39Å; L150-L164 HydrophobicContact CD1-CD2 4.17Å; L150-L164 HydrophobicContact CD1-CG 3.82Å; L150-L164 HydrophobicContact CD2-CD2 4.32Å; L150-L164 HydrophobicContact CG-CD1 4.14Å; L150-L164 HydrophobicContact CG-CD2 3.74Å; L150-L164 HydrophobicContact CG-CG 3.81Å; F160-L164 PolarHBondContact O-N 3.45Å; R161-L164 PolarHBondContact O-N 2.86Å; L164-L167 PolarHBondContact O-N 2.94Å; L164-K168 WeakPolarHBondContact O-CB 3.49Å; L164-K168 PolarHBondContact O-N 3.39Å
165	H	94.9	Very high	93.2	Very high	72 Å²	72	26.7 Å²	26.7	33%	0.333	13%	0.132	S	C	.	.	H	α-helix	trans	-62.4	-45.8	173.8	-77.5	-66.9	0	0	0	111.4	R161 Q162 L167 K168 E169	R161-H165 PolarHBondContact O-CD2 2.94Å; R161-H165 PolarHBondContact O-N 2.83Å; Q162-H165 PolarHBondContact O-N 3.43Å; H165-L167 VanDerWaalsContact C-N 3.34Å; H165-L167 PolarHBondContact O-N 2.92Å; H165-K168 PolarHBondContact O-N 3.32Å; H165-E169 WeakPolarHBondContact O-CB 3.11Å; H165-E169 PolarHBondContact O-N 2.84Å
166	S	93.5	Very high	92.8	Very high	15 Å²	15	28.1 Å²	28.1	11%	0.105	14%	0.137	C	C	.	.	H	α-helix	trans	-59.3	-44.9	178	-53.4	0	0	0	0	111.4	Q162 C163 E169 I170	Q162-S166 WeakPolarHBondContact O-CB 3.41Å; Q162-S166 PolarHBondContact O-N 2.98Å; Q162-S166 PolarHBondContact O-OG 3.47Å; C163-S166 PolarHBondContact O-N 2.83Å; S166-E169 PolarHBondContact O-N 2.92Å; S166-I170 WeakPolarHBondContact O-CB 3.29Å; S166-I170 WeakPolarHBondContact O-CD1 3.32Å; S166-I170 VanDerWaalsContact O-CG1 3.25Å; S166-I170 WeakPolarHBondContact O-CG1 3.28Å; S166-I170 PolarHBondContact O-N 3.01Å
167	L	94.4	Very high	92.3	Very high	1 Å²	1	28.2 Å²	28.2	1%	0.005	14%	0.137	C	C	.	.	H	α-helix	trans	-61.6	-48.6	175.3	178.8	58.3	0	0	0	112.3	L18 C163 L164 H165 E169 I170 I171 I217 W220 I221	L18-L167 HydrophobicContact CD1-CD2 3.57Å; L18-L167 HydrophobicContact CD2-CD2 4.38Å; C163-L167 PolarHBondContact O-N 3.2Å; L164-L167 PolarHBondContact O-N 2.94Å; H165-L167 VanDerWaalsContact C-N 3.34Å; H165-L167 PolarHBondContact O-N 2.92Å; L167-E169 VanDerWaalsContact C-N 3.32Å; L167-E169 PolarHBondContact O-N 2.84Å; L167-I170 PolarHBondContact O-N 3.44Å; L167-I171 HydrophobicContact CD1-CD1 3.81Å; L167-I171 HydrophobicContact CD1-CG1 4.19Å; L167-I171 HydrophobicContact CG-CD1 3.86Å; L167-I171 VanDerWaalsContact O-CG1 3.29Å; L167-I171 WeakPolarHBondContact O-CG1 3.37Å; L167-I171 PolarHBondContact O-N 3.46Å; L167-I217 HydrophobicContact CD1-CG2 3.81Å; L167-W220 HydrophobicContact CB-CH2 3.75Å; L167-W220 HydrophobicContact CB-CZ3 3.73Å; L167-W220 HydrophobicContact CD1-CE3 3.87Å; L167-W220 HydrophobicContact CD1-CH2 4.46Å; L167-W220 HydrophobicContact CD1-CZ3 3.8Å; L167-W220 HydrophobicContact CD2-CZ3 4.19Å; L167-W220 HydrophobicContact CG-CZ3 4.1Å; L167-I221 HydrophobicContact CD1-CD1 4.17Å; L167-I221 HydrophobicContact CD1-CG1 3.98Å; L167-I221 HydrophobicContact CD2-CD1 4.13Å; L167-I221 HydrophobicContact CD2-CG1 4Å
168	K	93.7	Very high	91.8	Very high	30 Å²	30	28.1 Å²	28.1	13%	0.13	14%	0.137	C	C	.	.	H	α-helix	trans	-59.6	-45.1	178.8	-179.1	-179.4	177.8	-66.7	0	111.1	T78 L99 F101 L148 L164 H165 I171 D172 W192	T78-K168 HydrophobicContact CG2-CD 4.13Å; L99-K168 HydrophobicContact CD1-CD 4.5Å; L99-K168 HydrophobicContact CD2-CB 3.89Å; L99-K168 HydrophobicContact CD2-CD 3.83Å; L99-K168 HydrophobicContact CD2-CG 4.47Å; L99-K168 HydrophobicContact CG-CD 4.27Å; F101-K168 HydrophobicContact CD1-CD 3.78Å; F101-K168 HydrophobicContact CD2-CD 4.49Å; F101-K168 HydrophobicContact CE1-CD 4.07Å; F101-K168 HydrophobicContact CG-CD 4.03Å; L148-K168 HydrophobicContact CD1-CB 3.97Å; L164-K168 WeakPolarHBondContact O-CB 3.49Å; L164-K168 PolarHBondContact O-N 3.39Å; H165-K168 PolarHBondContact O-N 3.32Å; K168-I171 PolarHBondContact O-N 3.32Å; K168-D172 IonicContact NZ-OD2 2.63Å; K168-D172 PolarHBondContact NZ-OD2 3.34Å; K168-D172 WeakPolarHBondContact O-CB 3.37Å; K168-D172 PolarHBondContact O-N 2.83Å; K168-W192 HydrophobicContact CG-CZ2 4.36Å
169	E	91.5	Very high	91.2	Very high	78 Å²	78	29.1 Å²	29.1	36%	0.364	14%	0.135	S	C	.	.	H	α-helix	trans	-64.1	-40.6	-179.6	-165.6	-156.4	-154	0	0	111.7	H165 S166 L167 R173 Y247	H165-E169 WeakPolarHBondContact O-CB 3.11Å; H165-E169 PolarHBondContact O-N 2.84Å; S166-E169 PolarHBondContact O-N 2.92Å; L167-E169 VanDerWaalsContact C-N 3.32Å; L167-E169 PolarHBondContact O-N 2.84Å; E169-R173 VanDerWaalsContact CG-NH1 3.31Å; E169-R173 WeakPolarHBondContact O-CG 3.3Å; E169-R173 PolarHBondContact O-N 3.02Å; E169-R173 IonicContact OE1-CZ 3.76Å; E169-R173 IonicContact OE1-NH1 2.79Å; E169-R173 PolarHBondContact OE1-NH1 2.69Å; E169-R173 IonicContact OE1-NH2 3.04Å; E169-R173 PolarHBondContact OE1-NH2 2.83Å; E169-R173 IonicContact OE2-CZ 3.11Å; E169-R173 IonicContact OE2-NH1 3.24Å; E169-R173 PolarHBondContact OE2-NH1 2.8Å; E169-R173 IonicContact OE2-NH2 3.57Å; E169-Y247 WeakPolarHBondContact OE2-CE1 3.19Å; E169-Y247 PolarHBondContact OE2-OH 2.95Å
170	I	90.4	Very high	90.5	Very high	5 Å²	5	29.4 Å²	29.4	3%	0.026	14%	0.136	C	C	.	.	H	α-helix	trans	-59.4	-47.8	170.8	-73	165.1	0	0	0	111.1	S166 L167 C174 I217 W220 Y550	S166-I170 WeakPolarHBondContact O-CB 3.29Å; S166-I170 WeakPolarHBondContact O-CD1 3.32Å; S166-I170 VanDerWaalsContact O-CG1 3.25Å; S166-I170 WeakPolarHBondContact O-CG1 3.28Å; S166-I170 PolarHBondContact O-N 3.01Å; L167-I170 PolarHBondContact O-N 3.44Å; I170-C174 PolarHBondContact O-N 2.87Å; I170-C174 VanDerWaalsContact O-N 3.13Å; I170-C174 PolarHBondContact O-SG 3.18Å; I170-I217 HydrophobicContact CG2-CD1 4.15Å; I170-I217 HydrophobicContact CG2-CG1 4.14Å; I170-W220 HydrophobicContact CD1-CZ2 4.17Å; I170-Y550 HydrophobicContact CD1-CE1 4.04Å; I170-Y550 HydrophobicContact CG1-CD1 4.39Å; I170-Y550 HydrophobicContact CG1-CE1 4.07Å; I170-Y550 HydrophobicContact CG2-CE1 3.82Å
171	I	91.6	Very high	89.7	Confident	0 Å²	0	29.8 Å²	29.8	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-66	-42.1	-179.3	-63.6	164.6	0	0	0	111.2	F20 L167 K168 C174 D175 F191 W192 I195 I217	F20-I171 HydrophobicContact CE1-CD1 4.41Å; F20-I171 HydrophobicContact CZ-CD1 4.49Å; L167-I171 HydrophobicContact CD1-CD1 3.81Å; L167-I171 HydrophobicContact CD1-CG1 4.19Å; L167-I171 HydrophobicContact CG-CD1 3.86Å; L167-I171 VanDerWaalsContact O-CG1 3.29Å; L167-I171 WeakPolarHBondContact O-CG1 3.37Å; L167-I171 PolarHBondContact O-N 3.46Å; K168-I171 PolarHBondContact O-N 3.32Å; I171-C174 WeakPolarHBondContact O-CB 3.37Å; I171-C174 PolarHBondContact O-N 3.24Å; I171-D175 PolarHBondContact O-N 2.87Å; I171-F191 HydrophobicContact CG2-CD1 3.96Å; I171-F191 HydrophobicContact CG2-CE1 4.14Å; I171-W192 HydrophobicContact CB-CH2 3.99Å; I171-W192 HydrophobicContact CB-CZ2 3.84Å; I171-W192 HydrophobicContact CD1-CH2 3.82Å; I171-W192 HydrophobicContact CD1-CZ3 4.1Å; I171-W192 HydrophobicContact CG2-CD2 3.73Å; I171-W192 VanDerWaalsContact CG2-CE2 3.44Å; I171-W192 HydrophobicContact CG2-CE3 3.95Å; I171-W192 HydrophobicContact CG2-CG 4.43Å; I171-W192 HydrophobicContact CG2-CH2 3.64Å; I171-W192 HydrophobicContact CG2-CZ2 3.4Å; I171-W192 VanDerWaalsContact CG2-CZ2 3.4Å; I171-W192 HydrophobicContact CG2-CZ3 3.92Å; I171-I195 HydrophobicContact CD1-CD1 4.05Å; I171-I195 HydrophobicContact CG1-CD1 4.17Å; I171-I217 HydrophobicContact CD1-CG2 4.47Å; I171-I217 HydrophobicContact CG1-CD1 4.12Å; I171-I217 HydrophobicContact CG1-CG2 4.13Å
172	D	89.6	Confident	88.8	Confident	51 Å²	51	28.3 Å²	28.3	27%	0.273	13%	0.132	S	C	.	.	H	α-helix	trans	-66.2	-40.6	179.5	-75.4	-26.4	0	0	0	112.1	K168 C174 D175 E176 W192	K168-D172 IonicContact NZ-OD2 2.63Å; K168-D172 PolarHBondContact NZ-OD2 3.34Å; K168-D172 WeakPolarHBondContact O-CB 3.37Å; K168-D172 PolarHBondContact O-N 2.83Å; D172-C174 VanDerWaalsContact C-N 3.29Å; D172-C174 PolarHBondContact O-N 2.86Å; D172-D175 PolarHBondContact O-N 3.16Å; D172-E176 PolarHBondContact O-N 3.11Å; D172-W192 WeakPolarHBondContact OD1-CZ2 3.5Å; D172-W192 PolarHBondContact OD1-NE1 3.04Å
173	R	88.1	Confident	87.9	Confident	26 Å²	26	27.9 Å²	27.9	10%	0.098	14%	0.14	C	C	.	.	H	α-helix	trans	-60.2	-39.3	171.7	-73.5	-174.8	-177	104.4	4.2	111.8	E169 Y177 Y247 L553 N554 H557	E169-R173 VanDerWaalsContact CG-NH1 3.31Å; E169-R173 WeakPolarHBondContact O-CG 3.3Å; E169-R173 PolarHBondContact O-N 3.02Å; E169-R173 IonicContact OE1-CZ 3.76Å; E169-R173 IonicContact OE1-NH1 2.79Å; E169-R173 PolarHBondContact OE1-NH1 2.69Å; E169-R173 IonicContact OE1-NH2 3.04Å; E169-R173 PolarHBondContact OE1-NH2 2.83Å; E169-R173 IonicContact OE2-CZ 3.11Å; E169-R173 IonicContact OE2-NH1 3.24Å; E169-R173 PolarHBondContact OE2-NH1 2.8Å; E169-R173 IonicContact OE2-NH2 3.57Å; R173-Y177 WeakPolarHBondContact O-CB 3.3Å; R173-Y177 PolarHBondContact O-N 2.91Å; R173-Y247 PolarHBondContact NH1-OH 2.79Å; R173-L553 HydrophobicContact CB-CB 4.35Å; R173-N554 PolarHBondContact NE-OD1 2.81Å; R173-N554 PolarHBondContact NH2-OD1 3.25Å; R173-H557 HydrophobicContact CG-CB 4.17Å
174	C	88.3	Confident	86.6	Confident	2 Å²	2	30.4 Å²	30.4	1%	0.014	16%	0.155	C	C	.	.	H	α-helix	trans	-66.1	-43.9	174.3	-65.1	0	0	0	0	111.7	I170 I171 D172 Y177 F178 F191	I170-C174 PolarHBondContact O-N 2.87Å; I170-C174 VanDerWaalsContact O-N 3.13Å; I170-C174 PolarHBondContact O-SG 3.18Å; I171-C174 WeakPolarHBondContact O-CB 3.37Å; I171-C174 PolarHBondContact O-N 3.24Å; D172-C174 VanDerWaalsContact C-N 3.29Å; D172-C174 PolarHBondContact O-N 2.86Å; C174-Y177 PolarHBondContact O-N 3.21Å; C174-F178 VanDerWaalsContact O-CD2 3.23Å; C174-F178 WeakPolarHBondContact O-CD2 3.44Å; C174-F178 PolarHBondContact O-N 3.03Å; C174-F191 HydrophobicContact CB-CD1 3.89Å; C174-F191 HydrophobicContact CB-CD2 4.41Å; C174-F191 HydrophobicContact CB-CE1 3.78Å; C174-F191 HydrophobicContact CB-CE2 4.28Å; C174-F191 HydrophobicContact CB-CG 4.22Å; C174-F191 HydrophobicContact CB-CZ 3.98Å
175	D	87.4	Confident	85.2	Confident	11 Å²	11	35.5 Å²	35.5	6%	0.059	17%	0.174	C	C	.	.	H	α-helix	trans	-62	-43	178.3	-171.8	64.3	0	0	0	112.1	I171 D172 K179 F191 W192	I171-D175 PolarHBondContact O-N 2.87Å; D172-D175 PolarHBondContact O-N 3.16Å; D175-K179 WeakPolarHBondContact O-CB 3.45Å; D175-K179 WeakPolarHBondContact O-CD 3.4Å; D175-K179 WeakPolarHBondContact O-CG 3.5Å; D175-K179 PolarHBondContact O-N 2.88Å; D175-K179 IonicContact OD1-NZ 2.6Å; D175-K179 WeakPolarHBondContact OD2-CE 3.34Å; D175-K179 IonicContact OD2-NZ 3.56Å; D175-K179 PolarHBondContact OD2-NZ 3.41Å; D175-F191 HydrophobicContact CB-CB 3.84Å; D175-F191 WeakPolarHBondContact OD1-CB 3.47Å; D175-F191 PolarHBondContact OD1-N 3.12Å; D175-W192 PolarHBondContact OD1-N 3.14Å
176	E	84.6	Confident	83.8	Confident	58 Å²	58	37.7 Å²	37.7	27%	0.271	20%	0.198	S	C	.	.	H	α-helix	trans	-63.5	-46.8	174.3	-168.5	-170.8	162.3	0	0	112.1	D172 K179 K180 H557	D172-E176 PolarHBondContact O-N 3.11Å; E176-K179 PolarHBondContact O-N 3.02Å; E176-K180 WeakPolarHBondContact O-CG 3.44Å; E176-K180 PolarHBondContact O-N 2.85Å; E176-K180 WeakPolarHBondContact OE1-CE 3.34Å; E176-K180 IonicContact OE1-NZ 3.01Å; E176-K180 PolarHBondContact OE1-NZ 3.39Å; E176-H557 IonicContact OE2-CE1 2.69Å; E176-H557 IonicContact OE2-CG 3.62Å; E176-H557 IonicContact OE2-ND1 2.74Å; E176-H557 PolarHBondContact OE2-ND1 3.14Å
177	Y	85	Confident	82.3	Confident	2 Å²	2	42.3 Å²	42.3	1%	0.008	22%	0.217	C	C	.	.	H	α-helix	trans	-58.8	-49.9	177.9	170.9	-106.6	0	0	0	112.2	R173 C174 K180 L181 L209 L553 I556 F569 H573 F576	R173-Y177 WeakPolarHBondContact O-CB 3.3Å; R173-Y177 PolarHBondContact O-N 2.91Å; C174-Y177 PolarHBondContact O-N 3.21Å; Y177-K180 PolarHBondContact O-N 2.89Å; Y177-L181 WeakPolarHBondContact O-CB 3.11Å; Y177-L181 PolarHBondContact O-N 3.17Å; Y177-L209 HydrophobicContact CE1-CD2 4.34Å; Y177-L553 HydrophobicContact CD1-CD2 4.19Å; Y177-L553 HydrophobicContact CD2-CD2 4.46Å; Y177-L553 HydrophobicContact CG-CD2 3.89Å; Y177-I556 HydrophobicContact CD2-CD1 3.71Å; Y177-I556 HydrophobicContact CD2-CG2 4.31Å; Y177-I556 HydrophobicContact CE2-CD1 3.77Å; Y177-F569 HydrophobicContact CD2-CE2 4.13Å; Y177-F569 AromaticContact CD2-CZ 3.97Å; Y177-F569 HydrophobicContact CD2-CZ 3.97Å; Y177-F569 HydrophobicContact CE2-CE2 4.45Å; Y177-F569 HydrophobicContact CE2-CZ 4.05Å; Y177-H573 AromaticContact CZ-ND1 3.72Å; Y177-H573 PolarHBondContact OH-CE1 3.09Å; Y177-H573 PolarHBondContact OH-ND1 3.36Å; Y177-F576 HydrophobicContact CE1-CE2 4.38Å; Y177-F576 HydrophobicContact CE1-CZ 4.36Å; Y177-F576 AromaticContact CE2-CD2 3.86Å; Y177-F576 HydrophobicContact CE2-CD2 3.86Å; Y177-F576 HydrophobicContact CE2-CE2 4.13Å; Y177-F576 HydrophobicContact CE2-CG 4.37Å; Y177-F576 AromaticContact CZ-CD2 3.77Å; Y177-F576 AromaticContact CZ-CE2 3.97Å; Y177-F576 AromaticContact CZ-CG 3.93Å; Y177-F576 WeakPolarHBondContact OH-CD1 3.12Å; Y177-F576 WeakPolarHBondContact OH-CG 3.33Å
178	F	84.8	Confident	80.9	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-70.1	-34	178.9	-77.1	-69.1	0	0	0	112.2	C174 L181 Y182 Y189 F191 L209 L210 V213	C174-F178 VanDerWaalsContact O-CD2 3.23Å; C174-F178 WeakPolarHBondContact O-CD2 3.44Å; C174-F178 PolarHBondContact O-N 3.03Å; F178-L181 HydrophobicContact CD1-CD2 4.03Å; F178-L181 HydrophobicContact CE1-CD2 4.22Å; F178-L181 PolarHBondContact O-N 2.81Å; F178-Y182 HydrophobicContact CB-CD2 4.23Å; F178-Y182 HydrophobicContact CB-CE2 4.39Å; F178-Y182 HydrophobicContact CD1-CD2 4.33Å; F178-Y182 AromaticContact CD1-CE2 3.81Å; F178-Y182 HydrophobicContact CD1-CE2 3.81Å; F178-Y182 WeakPolarHBondContact O-CB 3.41Å; F178-Y182 VanDerWaalsContact O-CD2 3.25Å; F178-Y182 WeakPolarHBondContact O-CD2 3.15Å; F178-Y182 PolarHBondContact O-N 2.77Å; F178-Y189 HydrophobicContact CB-CD1 3.69Å; F178-Y189 HydrophobicContact CB-CE1 3.54Å; F178-Y189 HydrophobicContact CG-CE1 4.14Å; F178-F191 AromaticContact CD2-CD2 3.44Å; F178-F191 HydrophobicContact CD2-CD2 3.44Å; F178-F191 VanDerWaalsContact CD2-CD2 3.44Å; F178-F191 AromaticContact CD2-CE2 3.9Å; F178-F191 HydrophobicContact CD2-CE2 3.9Å; F178-F191 HydrophobicContact CD2-CG 4.26Å; F178-F191 AromaticContact CE2-CD2 3.78Å; F178-F191 HydrophobicContact CE2-CD2 3.78Å; F178-F191 AromaticContact CE2-CE2 3.73Å; F178-F191 HydrophobicContact CE2-CE2 3.73Å; F178-F191 HydrophobicContact CG-CD2 4.33Å; F178-L209 HydrophobicContact CE1-CD2 4.22Å; F178-L209 HydrophobicContact CE1-CG 4.05Å; F178-L209 HydrophobicContact CZ-CG 4.08Å; F178-L210 HydrophobicContact CD2-CD1 4.29Å; F178-L210 HydrophobicContact CE1-CB 4.02Å; F178-L210 HydrophobicContact CE1-CD1 4.29Å; F178-L210 HydrophobicContact CE2-CD1 4.05Å; F178-L210 HydrophobicContact CZ-CB 4.17Å; F178-L210 HydrophobicContact CZ-CD1 4.05Å; F178-V213 HydrophobicContact CE2-CB 4.12Å; F178-V213 HydrophobicContact CE2-CG1 4.06Å; F178-V213 HydrophobicContact CE2-CG2 4.32Å; F178-V213 HydrophobicContact CZ-CB 4.24Å; F178-V213 HydrophobicContact CZ-CG2 4.13Å
179	K	82	Confident	80	Confident	71 Å²	71	46.9 Å²	46.9	31%	0.309	25%	0.248	S	C	.	.	H	α-helix	trans	-58.5	-46.8	170.8	-83.2	168.4	174	172.1	0	111.8	D175 E176 S183 Y189	D175-K179 WeakPolarHBondContact O-CB 3.45Å; D175-K179 WeakPolarHBondContact O-CD 3.4Å; D175-K179 WeakPolarHBondContact O-CG 3.5Å; D175-K179 PolarHBondContact O-N 2.88Å; D175-K179 IonicContact OD1-NZ 2.6Å; D175-K179 WeakPolarHBondContact OD2-CE 3.34Å; D175-K179 IonicContact OD2-NZ 3.56Å; D175-K179 PolarHBondContact OD2-NZ 3.41Å; E176-K179 PolarHBondContact O-N 3.02Å; K179-S183 WeakPolarHBondContact O-CB 3.22Å; K179-S183 PolarHBondContact O-N 3.46Å; K179-Y189 VanDerWaalsContact CG-O 3.28Å; K179-Y189 WeakPolarHBondContact CG-O 3.11Å
180	K	79.8	Confident	79.3	Confident	50 Å²	50	43.7 Å²	43.7	22%	0.217	23%	0.234	C	C	.	.	H	α-helix	trans	-59.9	-48.7	174.2	-70	175.3	-175.4	172.6	0	110.7	E176 Y177 Y182 S183 V184 F569	E176-K180 WeakPolarHBondContact O-CG 3.44Å; E176-K180 PolarHBondContact O-N 2.85Å; E176-K180 WeakPolarHBondContact OE1-CE 3.34Å; E176-K180 IonicContact OE1-NZ 3.01Å; E176-K180 PolarHBondContact OE1-NZ 3.39Å; Y177-K180 PolarHBondContact O-N 2.89Å; K180-Y182 PolarHBondContact O-N 3.33Å; K180-S183 PolarHBondContact O-N 2.8Å; K180-V184 PolarHBondContact O-N 2.99Å; K180-F569 HydrophobicContact CB-CD2 3.88Å; K180-F569 HydrophobicContact CB-CE1 4.18Å; K180-F569 HydrophobicContact CB-CE2 3.42Å; K180-F569 VanDerWaalsContact CB-CE2 3.42Å; K180-F569 HydrophobicContact CB-CG 4.42Å; K180-F569 HydrophobicContact CB-CZ 3.59Å; K180-F569 HydrophobicContact CD-CD2 4Å; K180-F569 HydrophobicContact CD-CE2 3.87Å; K180-F569 HydrophobicContact CG-CE2 4.25Å
181	L	80.2	Confident	79.1	Confident	8 Å²	8	43.5 Å²	43.5	4%	0.042	23%	0.233	C	C	.	.	H	α-helix	trans	-60.3	-43.1	-179.2	-175.1	62.5	0	0	0	114.1	Y177 F178 L209 F569 H573	Y177-L181 WeakPolarHBondContact O-CB 3.11Å; Y177-L181 PolarHBondContact O-N 3.17Å; F178-L181 HydrophobicContact CD1-CD2 4.03Å; F178-L181 HydrophobicContact CE1-CD2 4.22Å; F178-L181 PolarHBondContact O-N 2.81Å; L181-L209 HydrophobicContact CD2-CD2 4.19Å; L181-F569 HydrophobicContact CB-CE1 3.99Å; L181-F569 HydrophobicContact CB-CZ 4.08Å; L181-F569 HydrophobicContact CD1-CE1 4.01Å; L181-H573 VanDerWaalsContact CD1-CE1 3.49Å; L181-H573 WeakPolarHBondContact CD1-CE1 3.4Å
182	Y	78.7	Confident	78.8	Confident	15 Å²	15	43.8 Å²	43.8	6%	0.059	23%	0.234	C	C	.	.	H	α-helix	trans	-83.9	-24.4	180	-74.9	-73	0	0	0	113.3	F178 K180 V184 R185 S186 Q187 Y189 D207	F178-Y182 HydrophobicContact CB-CD2 4.23Å; F178-Y182 HydrophobicContact CB-CE2 4.39Å; F178-Y182 HydrophobicContact CD1-CD2 4.33Å; F178-Y182 AromaticContact CD1-CE2 3.81Å; F178-Y182 HydrophobicContact CD1-CE2 3.81Å; F178-Y182 WeakPolarHBondContact O-CB 3.41Å; F178-Y182 VanDerWaalsContact O-CD2 3.25Å; F178-Y182 WeakPolarHBondContact O-CD2 3.15Å; F178-Y182 PolarHBondContact O-N 2.77Å; K180-Y182 PolarHBondContact O-N 3.33Å; Y182-V184 VanDerWaalsContact C-N 3.34Å; Y182-V184 PolarHBondContact O-N 3.1Å; Y182-R185 CarbonylContact O-C 3.25Å; Y182-R185 VanDerWaalsContact O-C 3.25Å; Y182-R185 WeakPolarHBondContact O-CA 3.13Å; Y182-R185 WeakPolarHBondContact O-CB 3.09Å; Y182-R185 PolarHBondContact O-N 3.28Å; Y182-S186 PolarHBondContact O-N 3.33Å; Y182-S186 VanDerWaalsContact O-N 3.08Å; Y182-Q187 CarbonylContact C-O 3.53Å; Y182-Q187 VanDerWaalsContact C-O 3.32Å; Y182-Q187 WeakPolarHBondContact CB-O 3.4Å; Y182-Q187 HydrophobicContact CD1-CB 4.33Å; Y182-Q187 PolarHBondContact O-N 3.01Å; Y182-Y189 AromaticContact CD2-CD1 3.51Å; Y182-Y189 HydrophobicContact CD2-CD1 3.51Å; Y182-Y189 HydrophobicContact CD2-CD2 4.12Å; Y182-Y189 HydrophobicContact CD2-CE1 4.19Å; Y182-Y189 AromaticContact CD2-CG 3.46Å; Y182-Y189 HydrophobicContact CD2-CG 3.46Å; Y182-Y189 VanDerWaalsContact CD2-CG 3.46Å; Y182-Y189 AromaticContact CE2-CD1 3.88Å; Y182-Y189 HydrophobicContact CE2-CD1 3.88Å; Y182-Y189 HydrophobicContact CE2-CD2 4.14Å; Y182-Y189 HydrophobicContact CE2-CE1 4.11Å; Y182-Y189 HydrophobicContact CE2-CE2 4.39Å; Y182-Y189 AromaticContact CE2-CG 3.89Å; Y182-Y189 HydrophobicContact CE2-CG 3.89Å; Y182-Y189 HydrophobicContact CG-CD1 4.46Å; Y182-Y189 HydrophobicContact CG-CG 4.05Å; Y182-D207 WeakPolarHBondContact OH-CB 3.31Å
183	S	75.2	Confident	78.4	Confident	86 Å²	86	43.7 Å²	43.7	60%	0.601	24%	0.238	S	C	*	.	H	α-helix	trans	-61.2	-42.3	170.5	-170.9	0	0	0	0	111.4	K179 K180 R185 S186	K179-S183 WeakPolarHBondContact O-CB 3.22Å; K179-S183 PolarHBondContact O-N 3.46Å; K180-S183 PolarHBondContact O-N 2.8Å; S183-R185 PolarHBondContact O-N 2.82Å; S183-S186 PolarHBondContact O-N 3.21Å
184	V	69	Low	78.2	Confident	55 Å²	55	43.5 Å²	43.5	33%	0.333	24%	0.239	S	C	.	.	H	α-helix	trans	-59	-33.6	170.9	177.7	0	0	0	0	111.5	K180 Y182 S186 I566 F569	K180-V184 PolarHBondContact O-N 2.99Å; Y182-V184 VanDerWaalsContact C-N 3.34Å; Y182-V184 PolarHBondContact O-N 3.1Å; V184-S186 VanDerWaalsContact C-N 3.28Å; V184-S186 PolarHBondContact O-N 2.76Å; V184-I566 HydrophobicContact CG1-CG2 4.17Å; V184-I566 HydrophobicContact CG2-CG2 4.06Å; V184-F569 HydrophobicContact CG2-CD1 4.49Å
185	R	67.5	Low	78.1	Confident	110 Å²	110	43.4 Å²	43.4	42%	0.415	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.5	9.4	175.2	-60.2	175.2	-179.3	175.5	-0.4	113.9	Y182 S183 Q187 D207	Y182-R185 CarbonylContact O-C 3.25Å; Y182-R185 VanDerWaalsContact O-C 3.25Å; Y182-R185 WeakPolarHBondContact O-CA 3.13Å; Y182-R185 WeakPolarHBondContact O-CB 3.09Å; Y182-R185 PolarHBondContact O-N 3.28Å; S183-R185 PolarHBondContact O-N 2.82Å; R185-Q187 VanDerWaalsContact C-N 3.26Å; R185-Q187 PolarHBondContact O-N 2.87Å; R185-D207 IonicContact CZ-OD2 2.73Å; R185-D207 IonicContact NH1-OD2 3.8Å; R185-D207 PolarHBondContact NH1-OD2 3.38Å; R185-D207 IonicContact NH2-OD2 3.88Å; R185-D207 PolarHBondContact NH2-OD2 2.95Å
186	S	64.1	Low	78	Confident	117 Å²	117	43.8 Å²	43.8	82%	0.818	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	56.4	32.3	-176.8	-58.3	0	0	0	0	114.8	Y182 S183 V184	Y182-S186 PolarHBondContact O-N 3.33Å; Y182-S186 VanDerWaalsContact O-N 3.08Å; S183-S186 PolarHBondContact O-N 3.21Å; V184-S186 VanDerWaalsContact C-N 3.28Å; V184-S186 PolarHBondContact O-N 2.76Å
187	Q	62.8	Low	77.7	Confident	112 Å²	112	43.2 Å²	43.2	52%	0.523	24%	0.243	S	C	.	.			trans	-119.9	125.7	179	-71.1	177	-9.1	0	0	110.6	Y182 R185 Y189	Y182-Q187 CarbonylContact C-O 3.53Å; Y182-Q187 VanDerWaalsContact C-O 3.32Å; Y182-Q187 WeakPolarHBondContact CB-O 3.4Å; Y182-Q187 HydrophobicContact CD1-CB 4.33Å; Y182-Q187 PolarHBondContact O-N 3.01Å; R185-Q187 VanDerWaalsContact C-N 3.26Å; R185-Q187 PolarHBondContact O-N 2.87Å; Q187-Y189 PolarHBondContact O-N 3.45Å
188	S	64.9	Low	76.7	Confident	91 Å²	91	49.2 Å²	49.2	64%	0.636	28%	0.275	S	S	*	.			trans	-79.6	106.6	174.1	-168.4	0	0	0	0	109.5	N106	N106-S188 PolarHBondContact ND2-OG 3.5Å
189	Y	73.6	Confident	75.4	Confident	37 Å²	37	55.5 Å²	55.5	15%	0.145	31%	0.305	C	S	.	.			trans	-118.4	148.8	-172.9	179.7	-98.6	0	0	0	112	F178 K179 Y182 Q187 F191 T194 L210	F178-Y189 HydrophobicContact CB-CD1 3.69Å; F178-Y189 HydrophobicContact CB-CE1 3.54Å; F178-Y189 HydrophobicContact CG-CE1 4.14Å; K179-Y189 VanDerWaalsContact CG-O 3.28Å; K179-Y189 WeakPolarHBondContact CG-O 3.11Å; Y182-Y189 AromaticContact CD2-CD1 3.51Å; Y182-Y189 HydrophobicContact CD2-CD1 3.51Å; Y182-Y189 HydrophobicContact CD2-CD2 4.12Å; Y182-Y189 HydrophobicContact CD2-CE1 4.19Å; Y182-Y189 AromaticContact CD2-CG 3.46Å; Y182-Y189 HydrophobicContact CD2-CG 3.46Å; Y182-Y189 VanDerWaalsContact CD2-CG 3.46Å; Y182-Y189 AromaticContact CE2-CD1 3.88Å; Y182-Y189 HydrophobicContact CE2-CD1 3.88Å; Y182-Y189 HydrophobicContact CE2-CD2 4.14Å; Y182-Y189 HydrophobicContact CE2-CE1 4.11Å; Y182-Y189 HydrophobicContact CE2-CE2 4.39Å; Y182-Y189 AromaticContact CE2-CG 3.89Å; Y182-Y189 HydrophobicContact CE2-CG 3.89Å; Y182-Y189 HydrophobicContact CG-CD1 4.46Å; Y182-Y189 HydrophobicContact CG-CG 4.05Å; Q187-Y189 PolarHBondContact O-N 3.45Å; Y189-F191 HydrophobicContact CE1-CB 3.92Å; Y189-F191 HydrophobicContact CE1-CD2 4.46Å; Y189-T194 WeakPolarHBondContact CE2-OG1 3.18Å; Y189-T194 WeakPolarHBondContact OH-CB 3.39Å; Y189-T194 PolarHBondContact OH-OG1 3.43Å; Y189-L210 HydrophobicContact CE1-CD1 4.48Å; Y189-L210 HydrophobicContact CE2-CD2 3.83Å; Y189-L210 WeakPolarHBondContact OH-CD1 3.38Å; Y189-L210 WeakPolarHBondContact OH-CD2 3.43Å
190	S	78.8	Confident	74.1	Confident	11 Å²	11	53.6 Å²	53.6	8%	0.077	30%	0.298	C	S	.	.			trans	-136.4	114.8	174	172.6	0	0	0	0	109.4	W192 S193 T194	S190-W192 VanDerWaalsContact C-N 3.29Å; S190-W192 PolarHBondContact O-N 3.1Å; S190-S193 PolarHBondContact O-N 2.9Å; S190-S193 VanDerWaalsContact O-N 3.16Å; S190-S193 PolarHBondContact OG-N 3.07Å; S190-S193 PolarHBondContact OG-OG 3Å; S190-T194 PolarHBondContact O-N 2.64Å
191	F	85.2	Confident	72.5	Confident	0 Å²	0	56 Å²	56	0%	0	33%	0.327	C	S	.	.	H	α-helix	trans	-65.3	-37.5	177.1	-174.8	-96.1	0	0	0	110.9	I171 C174 D175 F178 Y189 S193 T194 I195 L210 V213 V214 I217	I171-F191 HydrophobicContact CG2-CD1 3.96Å; I171-F191 HydrophobicContact CG2-CE1 4.14Å; C174-F191 HydrophobicContact CB-CD1 3.89Å; C174-F191 HydrophobicContact CB-CD2 4.41Å; C174-F191 HydrophobicContact CB-CE1 3.78Å; C174-F191 HydrophobicContact CB-CE2 4.28Å; C174-F191 HydrophobicContact CB-CG 4.22Å; C174-F191 HydrophobicContact CB-CZ 3.98Å; D175-F191 HydrophobicContact CB-CB 3.84Å; D175-F191 WeakPolarHBondContact OD1-CB 3.47Å; D175-F191 PolarHBondContact OD1-N 3.12Å; F178-F191 AromaticContact CD2-CD2 3.44Å; F178-F191 HydrophobicContact CD2-CD2 3.44Å; F178-F191 VanDerWaalsContact CD2-CD2 3.44Å; F178-F191 AromaticContact CD2-CE2 3.9Å; F178-F191 HydrophobicContact CD2-CE2 3.9Å; F178-F191 HydrophobicContact CD2-CG 4.26Å; F178-F191 AromaticContact CE2-CD2 3.78Å; F178-F191 HydrophobicContact CE2-CD2 3.78Å; F178-F191 AromaticContact CE2-CE2 3.73Å; F178-F191 HydrophobicContact CE2-CE2 3.73Å; F178-F191 HydrophobicContact CG-CD2 4.33Å; Y189-F191 HydrophobicContact CE1-CB 3.92Å; Y189-F191 HydrophobicContact CE1-CD2 4.46Å; F191-S193 PolarHBondContact O-N 3.27Å; F191-T194 WeakPolarHBondContact O-CA 3.38Å; F191-T194 WeakPolarHBondContact O-CB 3.33Å; F191-T194 PolarHBondContact O-N 2.74Å; F191-I195 HydrophobicContact CE1-CB 4.43Å; F191-I195 HydrophobicContact CE1-CD1 4.42Å; F191-I195 PolarHBondContact O-N 3.41Å; F191-L210 HydrophobicContact CD2-CD1 3.54Å; F191-L210 HydrophobicContact CE2-CD1 3.59Å; F191-V213 HydrophobicContact CE2-CG1 4.11Å; F191-V213 HydrophobicContact CZ-CG1 4.04Å; F191-V214 HydrophobicContact CE2-CG2 3.69Å; F191-V214 HydrophobicContact CZ-CG2 3.84Å; F191-I217 HydrophobicContact CE1-CD1 3.59Å; F191-I217 HydrophobicContact CZ-CD1 3.64Å
192	W	86.2	Confident	70.9	Confident	6 Å²	6	63.1 Å²	63.1	2%	0.023	36%	0.36	C	S	.	.	H	α-helix	trans	-52.5	-39.7	171	-82.4	108.2	0	0	0	113.1	F20 F101 L148 K168 I171 D172 D175 S190 T194 I195 L196	F20-W192 HydrophobicContact CD1-CZ3 4.43Å; F20-W192 HydrophobicContact CE1-CZ3 4.05Å; F101-W192 HydrophobicContact CE1-CH2 4.4Å; F101-W192 AromaticContact CE2-CH2 3.71Å; F101-W192 HydrophobicContact CE2-CH2 3.71Å; F101-W192 AromaticContact CE2-CZ2 3.65Å; F101-W192 HydrophobicContact CE2-CZ2 3.65Å; F101-W192 HydrophobicContact CE2-CZ3 4.16Å; F101-W192 AromaticContact CZ-CH2 3.35Å; F101-W192 HydrophobicContact CZ-CH2 3.35Å; F101-W192 AromaticContact CZ-CZ2 3.78Å; F101-W192 HydrophobicContact CZ-CZ2 3.78Å; F101-W192 AromaticContact CZ-CZ3 3.77Å; F101-W192 HydrophobicContact CZ-CZ3 3.77Å; L148-W192 HydrophobicContact CD1-CH2 4.42Å; K168-W192 HydrophobicContact CG-CZ2 4.36Å; I171-W192 HydrophobicContact CB-CH2 3.99Å; I171-W192 HydrophobicContact CB-CZ2 3.84Å; I171-W192 HydrophobicContact CD1-CH2 3.82Å; I171-W192 HydrophobicContact CD1-CZ3 4.1Å; I171-W192 HydrophobicContact CG2-CD2 3.73Å; I171-W192 VanDerWaalsContact CG2-CE2 3.44Å; I171-W192 HydrophobicContact CG2-CE3 3.95Å; I171-W192 HydrophobicContact CG2-CG 4.43Å; I171-W192 HydrophobicContact CG2-CH2 3.64Å; I171-W192 HydrophobicContact CG2-CZ2 3.4Å; I171-W192 VanDerWaalsContact CG2-CZ2 3.4Å; I171-W192 HydrophobicContact CG2-CZ3 3.92Å; D172-W192 WeakPolarHBondContact OD1-CZ2 3.5Å; D172-W192 PolarHBondContact OD1-NE1 3.04Å; D175-W192 PolarHBondContact OD1-N 3.14Å; S190-W192 VanDerWaalsContact C-N 3.29Å; S190-W192 PolarHBondContact O-N 3.1Å; W192-T194 VanDerWaalsContact C-N 3.3Å; W192-T194 PolarHBondContact O-N 2.87Å; W192-I195 HydrophobicContact CE3-CG2 4.3Å; W192-I195 WeakPolarHBondContact O-CG2 3.16Å; W192-L196 WeakPolarHBondContact O-CB 3.4Å; W192-L196 VanDerWaalsContact O-CD1 3.29Å; W192-L196 WeakPolarHBondContact O-CD1 3.27Å; W192-L196 WeakPolarHBondContact O-CG 3.47Å; W192-L196 PolarHBondContact O-N 2.76Å
193	S	80.6	Confident	69.4	Low	49 Å²	49	69.3 Å²	69.3	34%	0.343	39%	0.389	S	S	.	.	H	α-helix	trans	-72	-26.9	177.9	-55	0	0	0	0	112.4	S190 F191 S197	S190-S193 PolarHBondContact O-N 2.9Å; S190-S193 VanDerWaalsContact O-N 3.16Å; S190-S193 PolarHBondContact OG-N 3.07Å; S190-S193 PolarHBondContact OG-OG 3Å; F191-S193 PolarHBondContact O-N 3.27Å; S193-S197 PolarHBondContact O-N 2.87Å
194	T	83.7	Confident	67.8	Low	22 Å²	22	77 Å²	77	14%	0.135	41%	0.406	C	S	.	.	H	α-helix	trans	-79.9	-46.1	179.3	-58.6	0	0	0	0	112.2	Y189 S190 F191 W192 L196 S197 L200 L210 V214	Y189-T194 WeakPolarHBondContact CE2-OG1 3.18Å; Y189-T194 WeakPolarHBondContact OH-CB 3.39Å; Y189-T194 PolarHBondContact OH-OG1 3.43Å; S190-T194 PolarHBondContact O-N 2.64Å; F191-T194 WeakPolarHBondContact O-CA 3.38Å; F191-T194 WeakPolarHBondContact O-CB 3.33Å; F191-T194 PolarHBondContact O-N 2.74Å; W192-T194 VanDerWaalsContact C-N 3.3Å; W192-T194 PolarHBondContact O-N 2.87Å; T194-L196 PolarHBondContact O-N 2.61Å; T194-S197 PolarHBondContact O-N 3.27Å; T194-S197 VanDerWaalsContact O-N 3.08Å; T194-L200 HydrophobicContact CG2-CD1 4.34Å; T194-L200 HydrophobicContact CG2-CD2 3.71Å; T194-L200 HydrophobicContact CG2-CG 4.27Å; T194-L210 HydrophobicContact CG2-CD1 4.34Å; T194-L210 HydrophobicContact CG2-CD2 4.27Å; T194-L210 HydrophobicContact CG2-CG 4.4Å; T194-V214 HydrophobicContact CG2-CG2 4.12Å
195	I	85.6	Confident	67	Low	0 Å²	0	82.4 Å²	82.4	0%	0	43%	0.432	C	S	.	.	H	α-helix	trans	-64.6	-29.2	177.7	-167.3	171.1	0	0	0	112.4	K41 I171 F191 W192 I217	K41-I195 WeakPolarHBondContact CD-O 3.38Å; K41-I195 PolarHBondContact NZ-O 3.27Å; I171-I195 HydrophobicContact CD1-CD1 4.05Å; I171-I195 HydrophobicContact CG1-CD1 4.17Å; F191-I195 HydrophobicContact CE1-CB 4.43Å; F191-I195 HydrophobicContact CE1-CD1 4.42Å; F191-I195 PolarHBondContact O-N 3.41Å; W192-I195 HydrophobicContact CE3-CG2 4.3Å; W192-I195 WeakPolarHBondContact O-CG2 3.16Å; I195-I217 HydrophobicContact CD1-CB 4.26Å; I195-I217 HydrophobicContact CD1-CD1 4.46Å; I195-I217 HydrophobicContact CD1-CG2 3.68Å
196	L	85.6	Confident	66.6	Low	19 Å²	19	79.4 Å²	79.4	10%	0.099	43%	0.426	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.7	-13.5	174.7	-69.5	173.1	0	0	0	113.9	F20 L40 W192 T194	F20-L196 HydrophobicContact CB-CD2 3.69Å; F20-L196 HydrophobicContact CD1-CD2 3.45Å; F20-L196 VanDerWaalsContact CD1-CD2 3.45Å; F20-L196 HydrophobicContact CE1-CD2 4.26Å; F20-L196 HydrophobicContact CG-CD2 3.8Å; L40-L196 HydrophobicContact CB-CD2 3.95Å; L40-L196 HydrophobicContact CD1-CD1 4.05Å; L40-L196 HydrophobicContact CD1-CD2 4.1Å; W192-L196 WeakPolarHBondContact O-CB 3.4Å; W192-L196 VanDerWaalsContact O-CD1 3.29Å; W192-L196 WeakPolarHBondContact O-CD1 3.27Å; W192-L196 WeakPolarHBondContact O-CG 3.47Å; W192-L196 PolarHBondContact O-N 2.76Å; T194-L196 PolarHBondContact O-N 2.61Å
197	S	77.9	Confident	66.9	Low	46 Å²	46	75.8 Å²	75.8	32%	0.322	40%	0.398	S	S	.	.			trans	-82.7	137.1	-179.2	-176.8	0	0	0	0	111.9	S193 T194 Q199	S193-S197 PolarHBondContact O-N 2.87Å; T194-S197 PolarHBondContact O-N 3.27Å; T194-S197 VanDerWaalsContact O-N 3.08Å; S197-Q199 PolarHBondContact OG-N 3.42Å
198	N	64	Low	67.5	Low	128 Å²	128	77.7 Å²	77.7	68%	0.684	41%	0.406	S	S	*	.	S	Bend	trans	-87.6	-0.4	171.7	-70.8	-26.9	0	0	0	113.1
199	Q	58.3	Low	68.2	Low	132 Å²	132	74.5 Å²	74.5	62%	0.617	38%	0.382	S	S	*	.			trans	-113.5	24	-169	-70.4	-172.8	-10.7	0	0	115.5	S197 A201 Q202	S197-Q199 PolarHBondContact OG-N 3.42Å; Q199-A201 PolarHBondContact O-N 3.14Å; Q199-Q202 PolarHBondContact O-N 2.86Å
200	L	53.6	Low	68.6	Low	32 Å²	32	72.9 Å²	72.9	17%	0.168	38%	0.376	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53	-25.3	176	-90.9	156.1	0	0	0	114.7	T194 F211 V214	T194-L200 HydrophobicContact CG2-CD1 4.34Å; T194-L200 HydrophobicContact CG2-CD2 3.71Å; T194-L200 HydrophobicContact CG2-CG 4.27Å; L200-F211 HydrophobicContact CB-CE2 4.13Å; L200-F211 HydrophobicContact CD2-CD2 4.24Å; L200-V214 HydrophobicContact CD1-CG1 3.93Å
201	A	47.3	Very low	68.6	Low	100 Å²	100	75.3 Å²	75.3	83%	0.826	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.8	-10.9	-176.1	0	0	0	0	0	115.8	Q199	Q199-A201 PolarHBondContact O-N 3.14Å
202	Q	45.5	Very low	68.4	Low	157 Å²	157	78 Å²	78	73%	0.734	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110	-15.1	-172.6	-71.9	-173.3	-6.3	0	0	115.4	Q199 R204	Q199-Q202 PolarHBondContact O-N 2.86Å; Q202-R204 PolarHBondContact O-N 3.19Å
203	Q	47.4	Very low	68.4	Low	145 Å²	145	78 Å²	78	68%	0.678	40%	0.398	S	S	*	.			trans	-81.4	109.8	175.8	-71.1	-171.3	-11.4	0	0	111.1	N205 V206	Q203-N205 PolarHBondContact O-N 3.09Å; Q203-V206 HydrophobicContact CB-CG2 3.61Å
204	R	42	Very low	68.7	Low	249 Å²	249	75.9 Å²	75.9	94%	0.94	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.4	3.2	-171.6	-71.6	-172.1	177.9	178.5	0.8	116.7	Q202	Q202-R204 PolarHBondContact O-N 3.19Å
205	N	52.6	Low	68.8	Low	167 Å²	167	77.3 Å²	77.3	89%	0.893	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-137.7	28.2	-171.3	-96.5	-7.1	0	0	0	113.8	Q203	Q203-N205 PolarHBondContact O-N 3.09Å
206	V	58.6	Low	68.9	Low	47 Å²	47	78.6 Å²	78.6	29%	0.285	39%	0.392	S	S	.	.			trans	-83.9	138.5	178.3	-172.3	0	0	0	0	110.8	Q203 L210	Q203-V206 HydrophobicContact CB-CG2 3.61Å; V206-L210 HydrophobicContact CG1-CD2 3.77Å; V206-L210 HydrophobicContact CG1-CG 4.32Å
207	D	70.6	Confident	69.2	Low	42 Å²	42	77.9 Å²	77.9	23%	0.225	39%	0.388	C	S	.	.			trans	-63	132.3	-178.8	-166	-36.1	0	0	0	111.3	Y182 R185 L209 L210 F211	Y182-D207 WeakPolarHBondContact OH-CB 3.31Å; R185-D207 IonicContact CZ-OD2 2.73Å; R185-D207 IonicContact NH1-OD2 3.8Å; R185-D207 PolarHBondContact NH1-OD2 3.38Å; R185-D207 IonicContact NH2-OD2 3.88Å; R185-D207 PolarHBondContact NH2-OD2 2.95Å; D207-L209 PolarHBondContact O-N 2.93Å; D207-L209 WeakPolarHBondContact OD1-CB 3.39Å; D207-L209 PolarHBondContact OD1-N 3.41Å; D207-L210 HydrophobicContact CB-CB 4.22Å; D207-L210 WeakPolarHBondContact O-CB 3.47Å; D207-L210 PolarHBondContact O-N 3.18Å; D207-L210 VanDerWaalsContact O-N 3.11Å; D207-F211 PolarHBondContact O-N 3.34Å
208	Q	74.5	Confident	69.8	Low	151 Å²	151	77 Å²	77	71%	0.706	38%	0.379	S	S	*	.	H	α-helix	trans	-62.6	-29.6	-179.9	-69.1	-171.6	0.5	0	0	112.8	K212	Q208-K212 WeakPolarHBondContact O-CG 3.36Å; Q208-K212 PolarHBondContact O-N 3.4Å
209	L	79.5	Confident	71	Confident	24 Å²	24	71.7 Å²	71.7	13%	0.126	35%	0.352	C	S	.	.	H	α-helix	trans	-63.4	-44.5	174.6	168.4	61	0	0	0	110.6	Y177 F178 L181 D207 K212 V213 F576 F579	Y177-L209 HydrophobicContact CE1-CD2 4.34Å; F178-L209 HydrophobicContact CE1-CD2 4.22Å; F178-L209 HydrophobicContact CE1-CG 4.05Å; F178-L209 HydrophobicContact CZ-CG 4.08Å; L181-L209 HydrophobicContact CD2-CD2 4.19Å; D207-L209 PolarHBondContact O-N 2.93Å; D207-L209 WeakPolarHBondContact OD1-CB 3.39Å; D207-L209 PolarHBondContact OD1-N 3.41Å; L209-K212 PolarHBondContact O-N 3.34Å; L209-V213 HydrophobicContact CD1-CG2 4.12Å; L209-V213 WeakPolarHBondContact O-CG2 3.35Å; L209-V213 PolarHBondContact O-N 3.15Å; L209-V213 VanDerWaalsContact O-N 3.11Å; L209-F576 HydrophobicContact CD1-CD1 4.4Å; L209-F576 HydrophobicContact CD1-CE1 4.24Å; L209-F579 HydrophobicContact CB-CE2 4.46Å; L209-F579 HydrophobicContact CD1-CE2 3.5Å; L209-F579 HydrophobicContact CD1-CZ 3.79Å
210	L	82.3	Confident	72.7	Confident	3 Å²	3	65.5 Å²	65.5	2%	0.016	32%	0.323	C	S	.	.	H	α-helix	trans	-63.2	-48.4	-178.9	171.1	58.3	0	0	0	111.8	F178 Y189 F191 T194 V206 D207 K212 V213 V214	F178-L210 HydrophobicContact CD2-CD1 4.29Å; F178-L210 HydrophobicContact CE1-CB 4.02Å; F178-L210 HydrophobicContact CE1-CD1 4.29Å; F178-L210 HydrophobicContact CE2-CD1 4.05Å; F178-L210 HydrophobicContact CZ-CB 4.17Å; F178-L210 HydrophobicContact CZ-CD1 4.05Å; Y189-L210 HydrophobicContact CE1-CD1 4.48Å; Y189-L210 HydrophobicContact CE2-CD2 3.83Å; Y189-L210 WeakPolarHBondContact OH-CD1 3.38Å; Y189-L210 WeakPolarHBondContact OH-CD2 3.43Å; F191-L210 HydrophobicContact CD2-CD1 3.54Å; F191-L210 HydrophobicContact CE2-CD1 3.59Å; T194-L210 HydrophobicContact CG2-CD1 4.34Å; T194-L210 HydrophobicContact CG2-CD2 4.27Å; T194-L210 HydrophobicContact CG2-CG 4.4Å; V206-L210 HydrophobicContact CG1-CD2 3.77Å; V206-L210 HydrophobicContact CG1-CG 4.32Å; D207-L210 HydrophobicContact CB-CB 4.22Å; D207-L210 WeakPolarHBondContact O-CB 3.47Å; D207-L210 PolarHBondContact O-N 3.18Å; D207-L210 VanDerWaalsContact O-N 3.11Å; L210-K212 VanDerWaalsContact C-N 3.28Å; L210-K212 PolarHBondContact O-N 2.71Å; L210-V213 PolarHBondContact O-N 3.11Å; L210-V214 HydrophobicContact CD1-CG2 4.08Å; L210-V214 WeakPolarHBondContact O-CG2 3.33Å; L210-V214 PolarHBondContact O-N 3.4Å
211	F	79.9	Confident	74.6	Confident	63 Å²	63	64 Å²	64	28%	0.276	32%	0.315	S	S	.	.	H	α-helix	trans	-57.4	-43.3	179.8	-167.6	-73.6	0	0	0	111.6	L200 D207 V214 Y215 Y590	L200-F211 HydrophobicContact CB-CE2 4.13Å; L200-F211 HydrophobicContact CD2-CD2 4.24Å; D207-F211 PolarHBondContact O-N 3.34Å; F211-V214 PolarHBondContact O-N 2.88Å; F211-Y215 PolarHBondContact O-N 3.22Å; F211-Y590 HydrophobicContact CD1-CD2 4.04Å; F211-Y590 AromaticContact CD1-CE2 3.78Å; F211-Y590 HydrophobicContact CD1-CE2 3.78Å; F211-Y590 HydrophobicContact CE1-CD1 4.24Å; F211-Y590 AromaticContact CE1-CD2 3.26Å; F211-Y590 HydrophobicContact CE1-CD2 3.26Å; F211-Y590 HydrophobicContact CE1-CE1 4.44Å; F211-Y590 AromaticContact CE1-CE2 3.5Å; F211-Y590 HydrophobicContact CE1-CE2 3.5Å; F211-Y590 AromaticContact CE1-CG 3.65Å; F211-Y590 HydrophobicContact CE1-CG 3.65Å; F211-Y590 AromaticContact CZ-CD2 3.94Å; F211-Y590 HydrophobicContact CZ-CD2 3.94Å; F211-Y590 HydrophobicContact CZ-CE2 4.41Å; F211-Y590 HydrophobicContact CZ-CG 4.45Å
212	K	81.3	Confident	76.8	Confident	55 Å²	55	59.5 Å²	59.5	24%	0.239	28%	0.277	C	S	.	.	H	α-helix	trans	-66.1	-42	179.7	-72	178.6	177.1	-175.1	0	112.7	Q208 L209 L210 V214 Y215 E216 F579	Q208-K212 WeakPolarHBondContact O-CG 3.36Å; Q208-K212 PolarHBondContact O-N 3.4Å; L209-K212 PolarHBondContact O-N 3.34Å; L210-K212 VanDerWaalsContact C-N 3.28Å; L210-K212 PolarHBondContact O-N 2.71Å; K212-V214 PolarHBondContact O-N 2.85Å; K212-Y215 PolarHBondContact O-N 3.13Å; K212-E216 WeakPolarHBondContact O-CG 3.33Å; K212-E216 PolarHBondContact O-N 3.35Å; K212-F579 HydrophobicContact CB-CD1 4.35Å; K212-F579 HydrophobicContact CB-CE1 3.64Å; K212-F579 HydrophobicContact CB-CE2 3.94Å; K212-F579 HydrophobicContact CB-CZ 3.41Å; K212-F579 VanDerWaalsContact CB-CZ 3.41Å; K212-F579 HydrophobicContact CD-CB 4.27Å; K212-F579 HydrophobicContact CD-CD1 3.74Å; K212-F579 HydrophobicContact CD-CD2 3.46Å; K212-F579 VanDerWaalsContact CD-CD2 3.46Å; K212-F579 HydrophobicContact CD-CE1 3.86Å; K212-F579 HydrophobicContact CD-CE2 3.6Å; K212-F579 HydrophobicContact CD-CG 3.53Å; K212-F579 HydrophobicContact CD-CZ 3.79Å; K212-F579 HydrophobicContact CG-CE1 4.38Å; K212-F579 HydrophobicContact CG-CE2 4.41Å; K212-F579 HydrophobicContact CG-CZ 4.26Å
213	V	85.2	Confident	79	Confident	8 Å²	8	53.8 Å²	53.8	5%	0.048	25%	0.252	C	S	.	.	H	α-helix	trans	-65.7	-37.8	176.8	176.4	0	0	0	0	111.6	F178 F191 L209 L210 E216 I217 F579	F178-V213 HydrophobicContact CE2-CB 4.12Å; F178-V213 HydrophobicContact CE2-CG1 4.06Å; F178-V213 HydrophobicContact CE2-CG2 4.32Å; F178-V213 HydrophobicContact CZ-CB 4.24Å; F178-V213 HydrophobicContact CZ-CG2 4.13Å; F191-V213 HydrophobicContact CE2-CG1 4.11Å; F191-V213 HydrophobicContact CZ-CG1 4.04Å; L209-V213 HydrophobicContact CD1-CG2 4.12Å; L209-V213 WeakPolarHBondContact O-CG2 3.35Å; L209-V213 PolarHBondContact O-N 3.15Å; L209-V213 VanDerWaalsContact O-N 3.11Å; L210-V213 PolarHBondContact O-N 3.11Å; V213-E216 PolarHBondContact O-N 3.43Å; V213-I217 PolarHBondContact O-N 2.86Å; V213-F579 HydrophobicContact CG2-CZ 4.39Å
214	V	87.5	Confident	81.3	Confident	3 Å²	3	47 Å²	47	2%	0.018	22%	0.22	C	C	.	.	H	α-helix	trans	-61	-49.8	173	174.9	0	0	0	0	110.6	F191 T194 L200 L210 F211 K212 E216 I217 E218	F191-V214 HydrophobicContact CE2-CG2 3.69Å; F191-V214 HydrophobicContact CZ-CG2 3.84Å; T194-V214 HydrophobicContact CG2-CG2 4.12Å; L200-V214 HydrophobicContact CD1-CG1 3.93Å; L210-V214 HydrophobicContact CD1-CG2 4.08Å; L210-V214 WeakPolarHBondContact O-CG2 3.33Å; L210-V214 PolarHBondContact O-N 3.4Å; F211-V214 PolarHBondContact O-N 2.88Å; K212-V214 PolarHBondContact O-N 2.85Å; V214-E216 VanDerWaalsContact C-N 3.26Å; V214-E216 PolarHBondContact O-N 2.95Å; V214-I217 PolarHBondContact O-N 2.96Å; V214-I217 VanDerWaalsContact O-N 3.12Å; V214-E218 HydrophobicContact CG1-CG 4.29Å; V214-E218 WeakPolarHBondContact O-CG 3.32Å; V214-E218 PolarHBondContact O-N 3.05Å
215	Y	86	Confident	83.8	Confident	53 Å²	53	35.2 Å²	35.2	21%	0.208	18%	0.176	C	C	.	.	H	α-helix	trans	-58.9	-35.2	177.2	178.3	-104	0	0	0	113.1	F211 K212 E218 S219 Y590 L592 L595	F211-Y215 PolarHBondContact O-N 3.22Å; K212-Y215 PolarHBondContact O-N 3.13Å; Y215-E218 PolarHBondContact O-N 3.27Å; Y215-S219 VanDerWaalsContact O-CB 3.28Å; Y215-S219 WeakPolarHBondContact O-CB 3.27Å; Y215-S219 PolarHBondContact O-N 2.78Å; Y215-Y590 AromaticContact CD1-CD1 3.67Å; Y215-Y590 HydrophobicContact CD1-CD1 3.67Å; Y215-Y590 HydrophobicContact CD1-CE1 4.06Å; Y215-Y590 AromaticContact CD2-CD1 3.72Å; Y215-Y590 HydrophobicContact CD2-CD1 3.72Å; Y215-Y590 HydrophobicContact CD2-CG 4.14Å; Y215-Y590 AromaticContact CE1-CD1 3.84Å; Y215-Y590 HydrophobicContact CE1-CD1 3.84Å; Y215-Y590 HydrophobicContact CE1-CE1 4.41Å; Y215-Y590 AromaticContact CE2-CD1 3.88Å; Y215-Y590 HydrophobicContact CE2-CD1 3.88Å; Y215-Y590 HydrophobicContact CE2-CG 4.31Å; Y215-Y590 AromaticContact CG-CD1 3.59Å; Y215-Y590 HydrophobicContact CG-CD1 3.59Å; Y215-Y590 HydrophobicContact CG-CE1 4.22Å; Y215-Y590 HydrophobicContact CG-CG 4.36Å; Y215-Y590 AromaticContact CZ-CD1 3.92Å; Y215-L592 HydrophobicContact CD2-CD1 4.39Å; Y215-L592 HydrophobicContact CE2-CD1 4.16Å; Y215-L595 HydrophobicContact CE2-CD1 4.41Å; Y215-L595 WeakPolarHBondContact OH-CD1 3.4Å
216	E	87.7	Confident	85.8	Confident	27 Å²	27	28.3 Å²	28.3	13%	0.126	14%	0.139	C	C	.	.	H	α-helix	trans	-64.8	-39.8	175.7	-75.9	177	-175.8	0	0	112.8	K212 V213 V214 W220 Q546 R549 F579	K212-E216 WeakPolarHBondContact O-CG 3.33Å; K212-E216 PolarHBondContact O-N 3.35Å; V213-E216 PolarHBondContact O-N 3.43Å; V214-E216 VanDerWaalsContact C-N 3.26Å; V214-E216 PolarHBondContact O-N 2.95Å; E216-W220 WeakPolarHBondContact O-CB 3.32Å; E216-W220 PolarHBondContact O-N 3.3Å; E216-Q546 HydrophobicContact CG-CG 4.33Å; E216-R549 VanDerWaalsContact CD-NH2 3.31Å; E216-R549 IonicContact OE1-CZ 2.76Å; E216-R549 VanDerWaalsContact OE1-CZ 3.25Å; E216-R549 IonicContact OE1-NE 2.91Å; E216-R549 PolarHBondContact OE1-NE 3.32Å; E216-R549 IonicContact OE1-NH2 2.84Å; E216-R549 PolarHBondContact OE1-NH2 3.33Å; E216-R549 IonicContact OE2-CZ 2.86Å; E216-R549 IonicContact OE2-NE 2.83Å; E216-R549 PolarHBondContact OE2-NE 3.49Å; E216-R549 IonicContact OE2-NH2 3.26Å; E216-R549 PolarHBondContact OE2-NH2 3.31Å; E216-F579 WeakPolarHBondContact OE1-CE1 3.39Å
217	I	90.5	Very high	87.5	Confident	3 Å²	3	26 Å²	26	2%	0.015	13%	0.125	C	C	.	.	H	α-helix	trans	-71.3	-40.1	175	-60.7	175.6	0	0	0	110.8	L167 I170 I171 F191 I195 V213 V214 S219 W220 I221	L167-I217 HydrophobicContact CD1-CG2 3.81Å; I170-I217 HydrophobicContact CG2-CD1 4.15Å; I170-I217 HydrophobicContact CG2-CG1 4.14Å; I171-I217 HydrophobicContact CD1-CG2 4.47Å; I171-I217 HydrophobicContact CG1-CD1 4.12Å; I171-I217 HydrophobicContact CG1-CG2 4.13Å; F191-I217 HydrophobicContact CE1-CD1 3.59Å; F191-I217 HydrophobicContact CZ-CD1 3.64Å; I195-I217 HydrophobicContact CD1-CB 4.26Å; I195-I217 HydrophobicContact CD1-CD1 4.46Å; I195-I217 HydrophobicContact CD1-CG2 3.68Å; V213-I217 PolarHBondContact O-N 2.86Å; V214-I217 PolarHBondContact O-N 2.96Å; V214-I217 VanDerWaalsContact O-N 3.12Å; I217-S219 VanDerWaalsContact C-N 3.32Å; I217-S219 PolarHBondContact O-N 2.69Å; I217-W220 WeakPolarHBondContact O-CB 3.4Å; I217-W220 PolarHBondContact O-N 2.78Å; I217-I221 HydrophobicContact CG2-CD1 4.2Å; I217-I221 WeakPolarHBondContact O-CG1 3.43Å; I217-I221 PolarHBondContact O-N 2.96Å
218	E	91	Very high	88.5	Confident	28 Å²	28	24.5 Å²	24.5	13%	0.131	12%	0.117	C	C	.	.	H	α-helix	trans	-63.4	-38.6	174.6	-66.5	-172.4	159.2	0	0	111.8	K41 Y43 V214 Y215 I221 T222 L592	K41-E218 IonicContact NZ-OE1 3.54Å; K41-E218 PolarHBondContact NZ-OE1 3.3Å; Y43-E218 HydrophobicContact CE1-CB 4.42Å; Y43-E218 HydrophobicContact CE1-CG 4.2Å; Y43-E218 WeakPolarHBondContact OH-CG 3.33Å; Y43-E218 PolarHBondContact OH-OE1 2.71Å; V214-E218 HydrophobicContact CG1-CG 4.29Å; V214-E218 WeakPolarHBondContact O-CG 3.32Å; V214-E218 PolarHBondContact O-N 3.05Å; Y215-E218 PolarHBondContact O-N 3.27Å; E218-I221 PolarHBondContact O-N 3.15Å; E218-T222 WeakPolarHBondContact O-CB 3.47Å; E218-T222 PolarHBondContact O-N 3.19Å; E218-T222 PolarHBondContact O-OG1 3.3Å; E218-L592 HydrophobicContact CB-CD1 3.67Å; E218-L592 HydrophobicContact CB-CD2 3.91Å; E218-L592 HydrophobicContact CB-CG 4.47Å
219	S	89.8	Confident	89.4	Confident	17 Å²	17	17.3 Å²	17.3	12%	0.119	8%	0.084	C	C	.	.	H	α-helix	trans	-66	-40	172.9	-176.8	0	0	0	0	112	Y215 I217 T222 N223	Y215-S219 VanDerWaalsContact O-CB 3.28Å; Y215-S219 WeakPolarHBondContact O-CB 3.27Å; Y215-S219 PolarHBondContact O-N 2.78Å; I217-S219 VanDerWaalsContact C-N 3.32Å; I217-S219 PolarHBondContact O-N 2.69Å; S219-T222 PolarHBondContact O-N 3Å; S219-N223 WeakPolarHBondContact O-CB 3.45Å; S219-N223 PolarHBondContact O-N 2.71Å; S219-N223 PolarHBondContact O-ND2 3Å
220	W	93	Very high	90	Very high	2 Å²	2	16.1 Å²	16.1	1%	0.008	8%	0.078	C	C	.	.	H	α-helix	trans	-60.8	-44.6	174.4	-176.5	106.7	0	0	0	111	L167 I170 E216 I217 N223 L224 V241 I541	L167-W220 HydrophobicContact CB-CH2 3.75Å; L167-W220 HydrophobicContact CB-CZ3 3.73Å; L167-W220 HydrophobicContact CD1-CE3 3.87Å; L167-W220 HydrophobicContact CD1-CH2 4.46Å; L167-W220 HydrophobicContact CD1-CZ3 3.8Å; L167-W220 HydrophobicContact CD2-CZ3 4.19Å; L167-W220 HydrophobicContact CG-CZ3 4.1Å; I170-W220 HydrophobicContact CD1-CZ2 4.17Å; E216-W220 WeakPolarHBondContact O-CB 3.32Å; E216-W220 PolarHBondContact O-N 3.3Å; I217-W220 WeakPolarHBondContact O-CB 3.4Å; I217-W220 PolarHBondContact O-N 2.78Å; W220-N223 PolarHBondContact O-N 2.95Å; W220-L224 HydrophobicContact CH2-CD2 4.09Å; W220-L224 HydrophobicContact CZ3-CD2 3.69Å; W220-L224 WeakPolarHBondContact O-CB 3.42Å; W220-L224 PolarHBondContact O-N 2.85Å; W220-V241 HydrophobicContact CH2-CG1 4.35Å; W220-V241 HydrophobicContact CZ2-CG1 3.57Å; W220-V241 PolarHBondContact NE1-O 3.41Å; W220-I541 HydrophobicContact CD2-CD1 3.89Å; W220-I541 HydrophobicContact CE3-CD1 4.42Å; W220-I541 HydrophobicContact CG-CD1 4.44Å; W220-I541 HydrophobicContact CH2-CD1 4.04Å; W220-I541 HydrophobicContact CZ2-CD1 3.48Å; W220-I541 VanDerWaalsContact CZ2-CD1 3.48Å; W220-I541 HydrophobicContact CZ3-CD1 4.46Å
221	I	94.8	Very high	90.5	Very high	0 Å²	0	16.7 Å²	16.7	0%	0	8%	0.081	C	C	.	.	H	α-helix	trans	-62.5	-45	175.6	-67.9	167.1	0	0	0	110.4	L18 F20 Y43 L167 I217 E218 N223 L224 L225	L18-I221 HydrophobicContact CB-CG2 4.24Å; L18-I221 HydrophobicContact CD1-CG1 4.26Å; L18-I221 HydrophobicContact CD1-CG2 3.96Å; L18-I221 HydrophobicContact CD2-CG2 4.5Å; L18-I221 HydrophobicContact CG-CG2 4.47Å; F20-I221 HydrophobicContact CE2-CD1 4.27Å; F20-I221 HydrophobicContact CZ-CD1 4.23Å; Y43-I221 HydrophobicContact CD1-CG2 4.15Å; Y43-I221 HydrophobicContact CD2-CD1 4.47Å; Y43-I221 HydrophobicContact CD2-CG2 3.92Å; Y43-I221 HydrophobicContact CE2-CD1 4.14Å; Y43-I221 HydrophobicContact CG-CG2 3.69Å; L167-I221 HydrophobicContact CD1-CD1 4.17Å; L167-I221 HydrophobicContact CD1-CG1 3.98Å; L167-I221 HydrophobicContact CD2-CD1 4.13Å; L167-I221 HydrophobicContact CD2-CG1 4Å; I217-I221 HydrophobicContact CG2-CD1 4.2Å; I217-I221 WeakPolarHBondContact O-CG1 3.43Å; I217-I221 PolarHBondContact O-N 2.96Å; E218-I221 PolarHBondContact O-N 3.15Å; I221-N223 PolarHBondContact O-N 3.46Å; I221-L224 WeakPolarHBondContact O-CB 3.31Å; I221-L224 PolarHBondContact O-N 3.44Å; I221-L225 HydrophobicContact CG2-CD1 4Å; I221-L225 WeakPolarHBondContact O-CG 3.5Å; I221-L225 PolarHBondContact O-N 3.12Å
222	T	92.6	Very high	91	Very high	5 Å²	5	15.2 Å²	15.2	3%	0.031	8%	0.077	C	C	.	.	H	α-helix	trans	-64.6	-41.1	-179.4	-56.1	0	0	0	0	111.5	E218 S219 L225 N226 L595 Y596	E218-T222 WeakPolarHBondContact O-CB 3.47Å; E218-T222 PolarHBondContact O-N 3.19Å; E218-T222 PolarHBondContact O-OG1 3.3Å; S219-T222 PolarHBondContact O-N 3Å; T222-L225 PolarHBondContact O-N 3.17Å; T222-N226 VanDerWaalsContact O-CG 3.31Å; T222-N226 PolarHBondContact O-N 3.47Å; T222-N226 PolarHBondContact O-ND2 3.44Å; T222-L595 HydrophobicContact CG2-CB 3.95Å; T222-Y596 HydrophobicContact CG2-CD2 3.99Å; T222-Y596 HydrophobicContact CG2-CG 4.39Å
223	N	93.2	Very high	91.3	Very high	38 Å²	38	14 Å²	14	20%	0.203	8%	0.08	C	C	.	.	H	α-helix	trans	-66.2	-39.4	175.1	-69.2	-22	0	0	0	112.1	S219 W220 I221 L225 N226 A227 F539 I541	S219-N223 WeakPolarHBondContact O-CB 3.45Å; S219-N223 PolarHBondContact O-N 2.71Å; S219-N223 PolarHBondContact O-ND2 3Å; W220-N223 PolarHBondContact O-N 2.95Å; I221-N223 PolarHBondContact O-N 3.46Å; N223-L225 VanDerWaalsContact C-N 3.27Å; N223-L225 PolarHBondContact O-N 3.42Å; N223-N226 WeakPolarHBondContact O-CB 3.32Å; N223-N226 PolarHBondContact O-N 2.94Å; N223-N226 VanDerWaalsContact O-N 3.07Å; N223-A227 PolarHBondContact O-N 3.46Å; N223-F539 WeakPolarHBondContact O-CE1 3.26Å; N223-I541 HydrophobicContact CB-CB 3.99Å; N223-I541 HydrophobicContact CB-CG2 4.3Å; N223-I541 VanDerWaalsContact CB-O 3.31Å; N223-I541 WeakPolarHBondContact CB-O 3.32Å; N223-I541 PolarHBondContact ND2-O 2.94Å
224	L	95	Very high	91.6	Very high	2 Å²	2	19.6 Å²	19.6	1%	0.01	10%	0.104	C	C	.	.	H	α-helix	trans	-59.7	-37.9	173.2	178.6	62.7	0	0	0	112	I15 C163 W220 I221 N226 A227 L239 I541	I15-L224 HydrophobicContact CD1-CD1 3.88Å; I15-L224 HydrophobicContact CD1-CD2 4.23Å; I15-L224 HydrophobicContact CD1-CG 3.83Å; C163-L224 HydrophobicContact CB-CD2 4.25Å; W220-L224 HydrophobicContact CH2-CD2 4.09Å; W220-L224 HydrophobicContact CZ3-CD2 3.69Å; W220-L224 WeakPolarHBondContact O-CB 3.42Å; W220-L224 PolarHBondContact O-N 2.85Å; I221-L224 WeakPolarHBondContact O-CB 3.31Å; I221-L224 PolarHBondContact O-N 3.44Å; L224-N226 VanDerWaalsContact C-N 3.31Å; L224-A227 VanDerWaalsContact O-CB 3.26Å; L224-A227 WeakPolarHBondContact O-CB 3.47Å; L224-A227 PolarHBondContact O-N 3.07Å; L224-L239 HydrophobicContact CD1-CD2 3.83Å; L224-I541 HydrophobicContact CB-CD1 4.35Å; L224-I541 HydrophobicContact CB-CG2 4.23Å; L224-I541 HydrophobicContact CD1-CD1 4.33Å; L224-I541 HydrophobicContact CD1-CG2 4.46Å
225	L	94.8	Very high	91.8	Very high	2 Å²	2	19.6 Å²	19.6	1%	0.01	10%	0.103	C	C	.	.	H	α-helix	trans	-75.5	-16.4	175.2	-64.7	166	0	0	0	113.9	I15 I221 T222 N223 A227 Y596	I15-L225 HydrophobicContact CB-CD2 4.09Å; I15-L225 HydrophobicContact CG2-CD2 3.5Å; I15-L225 VanDerWaalsContact CG2-CD2 3.5Å; I221-L225 HydrophobicContact CG2-CD1 4Å; I221-L225 WeakPolarHBondContact O-CG 3.5Å; I221-L225 PolarHBondContact O-N 3.12Å; T222-L225 PolarHBondContact O-N 3.17Å; N223-L225 VanDerWaalsContact C-N 3.27Å; N223-L225 PolarHBondContact O-N 3.42Å; L225-A227 VanDerWaalsContact C-N 3.33Å; L225-Y596 HydrophobicContact CB-CD2 4.38Å; L225-Y596 HydrophobicContact CB-CE2 3.7Å
226	N	94.2	Very high	92.3	Very high	21 Å²	21	17 Å²	17	11%	0.112	9%	0.093	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.4	-7.3	171.1	-69.6	-28.1	0	0	0	112.6	T222 N223 L224 F539 L595 Y596 N597	T222-N226 VanDerWaalsContact O-CG 3.31Å; T222-N226 PolarHBondContact O-N 3.47Å; T222-N226 PolarHBondContact O-ND2 3.44Å; N223-N226 WeakPolarHBondContact O-CB 3.32Å; N223-N226 PolarHBondContact O-N 2.94Å; N223-N226 VanDerWaalsContact O-N 3.07Å; L224-N226 VanDerWaalsContact C-N 3.31Å; N226-F539 HydrophobicContact CB-CZ 4.12Å; N226-L595 PolarHBondContact ND2-O 3.23Å; N226-Y596 VanDerWaalsContact OD1-CD2 3.27Å; N226-Y596 WeakPolarHBondContact OD1-CD2 3.42Å; N226-N597 VanDerWaalsContact OD1-C 3.31Å; N226-N597 PolarHBondContact OD1-N 2.75Å
227	A	93.6	Very high	92.6	Very high	0 Å²	0	15.8 Å²	15.8	0%	0	9%	0.087	C	C	.	.	P	Polyproline II helix	trans	-64.5	131.4	-177	0	0	0	0	0	111.9	L14 N223 L224 L225 L239 F539	L14-A227 HydrophobicContact CB-CB 4.3Å; L14-A227 VanDerWaalsContact CB-O 3.24Å; L14-A227 WeakPolarHBondContact CB-O 3.3Å; L14-A227 HydrophobicContact CD2-CB 4.07Å; L14-A227 PolarHBondContact N-O 2.93Å; N223-A227 PolarHBondContact O-N 3.46Å; L224-A227 VanDerWaalsContact O-CB 3.26Å; L224-A227 WeakPolarHBondContact O-CB 3.47Å; L224-A227 PolarHBondContact O-N 3.07Å; L225-A227 VanDerWaalsContact C-N 3.33Å; A227-L239 HydrophobicContact CB-CD1 4.25Å; A227-F539 HydrophobicContact CB-CD1 4.21Å; A227-F539 HydrophobicContact CB-CE1 4.1Å
228	P	93.1	Very high	92.8	Very high	9 Å²	9	18.2 Å²	18.2	6%	0.058	10%	0.097	C	C	.	.	B	Isolated β-bridge	trans	-81.3	148.8	-177.8	32.9	-35.3	0	0	0	112.6	L237 I537 F539 P599 L605	P228-L237 HydrophobicContact CG-CD1 4.1Å; P228-I537 HydrophobicContact CG-CG2 4.24Å; P228-F539 HydrophobicContact CG-CD2 4.46Å; P228-P599 HydrophobicContact CB-CG 4.23Å; P228-L605 HydrophobicContact CB-CD1 3.84Å; P228-L605 HydrophobicContact CB-CD2 3.42Å; P228-L605 VanDerWaalsContact CB-CD2 3.42Å; P228-L605 HydrophobicContact CB-CG 4.24Å; P228-L605 HydrophobicContact CG-CD2 4.3Å
229	V	93.2	Very high	92.9	Very high	0 Å²	0	16.9 Å²	16.9	0%	0	9%	0.09	C	C	.	.	P	Polyproline II helix	trans	-67.4	140.1	170.1	76.5	0	0	0	0	110.3	Y10 C11 P12 H154 L254 M602 L605	Y10-V229 HydrophobicContact CD1-CG1 4.38Å; Y10-V229 HydrophobicContact CE1-CG2 4.45Å; C11-V229 WeakPolarHBondContact O-CG1 3.44Å; P12-V229 PolarHBondContact O-N 3.31Å; H154-V229 WeakPolarHBondContact NE2-CG2 3.47Å; V229-L254 HydrophobicContact CG2-CD1 3.87Å; V229-M602 HydrophobicContact CG1-CE 3.84Å; V229-M602 HydrophobicContact CG1-SD 3.65Å; V229-L605 HydrophobicContact CG1-CD1 4.48Å
230	P	92.6	Very high	93.1	Very high	0 Å²	0	16.6 Å²	16.6	0%	0	9%	0.088	C	C	.	.	P	Polyproline II helix	trans	-64	141.4	164.3	27.3	-35.5	0	0	0	110.9	F156 T235 F252 L254	F156-P230 HydrophobicContact CZ-CG 4.21Å; P230-T235 VanDerWaalsContact CB-O 3.29Å; P230-T235 WeakPolarHBondContact CB-O 3.31Å; P230-F252 HydrophobicContact CG-CB 4.04Å; P230-L254 HydrophobicContact CG-CD1 4.19Å; P230-L254 HydrophobicContact CG-CG 4.2Å; P230-L254 WeakPolarHBondContact O-CD1 3.41Å
231	I	91	Very high	93	Very high	15 Å²	15	16.6 Å²	16.6	8%	0.077	9%	0.088	C	C	.	.	P	Polyproline II helix	trans	-80.3	124.5	172.7	-47	-176.1	0	0	0	109.6	G233 K234 T235 M602 L605 L606	I231-G233 PolarHBondContact O-N 3.12Å; I231-K234 HydrophobicContact CB-CB 4.2Å; I231-K234 HydrophobicContact CG2-CB 4.18Å; I231-K234 HydrophobicContact CG2-CD 3.99Å; I231-K234 HydrophobicContact CG2-CG 4.49Å; I231-K234 PolarHBondContact O-N 3.02Å; I231-K234 VanDerWaalsContact O-N 3.09Å; I231-T235 HydrophobicContact CB-CG2 4.39Å; I231-T235 HydrophobicContact CD1-CG2 4.39Å; I231-T235 HydrophobicContact CG1-CG2 4.34Å; I231-T235 PolarHBondContact N-OG1 3.47Å; I231-T235 PolarHBondContact O-N 3.14Å; I231-T235 VanDerWaalsContact O-N 3.12Å; I231-M602 HydrophobicContact CB-CE 4.24Å; I231-M602 HydrophobicContact CD1-CE 4.46Å; I231-M602 HydrophobicContact CG1-CE 3.74Å; I231-M602 HydrophobicContact CG2-CE 4.19Å; I231-L605 HydrophobicContact CD1-CB 4.45Å; I231-L606 HydrophobicContact CD1-CB 3.94Å; I231-L606 HydrophobicContact CD1-CD1 3.77Å; I231-L606 HydrophobicContact CD1-CG 3.66Å
232	P	90.4	Very high	92.7	Very high	32 Å²	32	16.8 Å²	16.8	21%	0.208	9%	0.09	C	C	.	.	T	Hydrogen-bonded Turn	trans	-47.3	129.6	178.6	-31.1	35.9	0	0	0	113.6	Y10 K234 L254	Y10-P232 HydrophobicContact CE1-CG 4.03Å; Y10-P232 HydrophobicContact CE2-CG 4.14Å; Y10-P232 WeakPolarHBondContact OH-CG 3.32Å; P232-K234 PolarHBondContact O-N 3.04Å; P232-L254 WeakPolarHBondContact CA-O 3.16Å; P232-L254 HydrophobicContact CB-CB 4.21Å; P232-L254 HydrophobicContact CG-CB 3.9Å; P232-L254 HydrophobicContact CG-CD1 4.29Å
233	G	88.8	Confident	92.4	Very high	28 Å²	28	16.8 Å²	16.8	29%	0.289	9%	0.09	S	C	.	.	T	Hydrogen-bonded Turn	trans	61.9	3.2	179	0	0	0	0	0	116.8	I231 L254 L534	I231-G233 PolarHBondContact O-N 3.12Å; G233-L254 PolarHBondContact N-O 3.29Å; G233-L534 WeakPolarHBondContact O-CD2 3.41Å
234	K	90.6	Very high	91.9	Very high	127 Å²	127	21.4 Å²	21.4	55%	0.552	11%	0.11	S	C	*	.	T	Hydrogen-bonded Turn	trans	-122.4	-38.8	-174.7	-65.8	177.7	-173.6	170.9	0	114.3	I231 P232 A535 L606	I231-K234 HydrophobicContact CB-CB 4.2Å; I231-K234 HydrophobicContact CG2-CB 4.18Å; I231-K234 HydrophobicContact CG2-CD 3.99Å; I231-K234 HydrophobicContact CG2-CG 4.49Å; I231-K234 PolarHBondContact O-N 3.02Å; I231-K234 VanDerWaalsContact O-N 3.09Å; P232-K234 PolarHBondContact O-N 3.04Å; K234-A535 PolarHBondContact O-N 3.2Å; K234-L606 HydrophobicContact CD-CD1 4.34Å
235	T	92.8	Very high	91.4	Very high	2 Å²	2	26.6 Å²	26.6	1%	0.012	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	148.9	-174.8	66.4	0	0	0	0	112.3	P230 I231 A535 I537 A609	P230-T235 VanDerWaalsContact CB-O 3.29Å; P230-T235 WeakPolarHBondContact CB-O 3.31Å; I231-T235 HydrophobicContact CB-CG2 4.39Å; I231-T235 HydrophobicContact CD1-CG2 4.39Å; I231-T235 HydrophobicContact CG1-CG2 4.34Å; I231-T235 PolarHBondContact N-OG1 3.47Å; I231-T235 PolarHBondContact O-N 3.14Å; I231-T235 VanDerWaalsContact O-N 3.12Å; T235-A535 CarbonylContact C-O 3.55Å; T235-A535 WeakPolarHBondContact CA-O 3.29Å; T235-A535 WeakPolarHBondContact CB-O 3.48Å; T235-A535 HydrophobicContact CG2-CB 4.31Å; T235-I537 HydrophobicContact CG2-CD1 4.26Å; T235-A609 HydrophobicContact CG2-CB 4.07Å
236	C	94.7	Very high	90.9	Very high	0 Å²	0	29 Å²	29	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	141.8	165.2	63.8	0	0	0	0	111	I251 F252 A253 L534 A535 I537	C236-I251 HydrophobicContact CB-CG2 4.31Å; C236-F252 CarbonylContact C-O 3.12Å; C236-F252 WeakPolarHBondContact CA-O 3.49Å; C236-A253 HydrophobicContact CB-CB 4.07Å; C236-L534 HydrophobicContact CB-CB 4.22Å; C236-L534 HydrophobicContact CB-CD1 4.07Å; C236-A535 PolarHBondContact N-O 2.91Å; C236-I537 PolarHBondContact O-N 3.24Å
237	L	94.6	Very high	90.6	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	128.8	173.3	175.4	78.4	0	0	0	109.3	L14 P228 L239 I251 F252 I537 F539	L14-L237 HydrophobicContact CD2-CD2 3.63Å; P228-L237 HydrophobicContact CG-CD1 4.1Å; L237-L239 HydrophobicContact CD2-CB 4.42Å; L237-I251 CarbonylContact O-C 3.59Å; L237-I251 VanDerWaalsContact O-CA 3.31Å; L237-I251 WeakPolarHBondContact O-CA 3.08Å; L237-F252 HydrophobicContact CB-CB 4.21Å; L237-F252 HydrophobicContact CD2-CB 4.48Å; L237-F252 HydrophobicContact CD2-CD2 3.85Å; L237-F252 HydrophobicContact CD2-CE2 4.44Å; L237-F252 HydrophobicContact CD2-CG 4.36Å; L237-F252 HydrophobicContact CG-CD2 4.44Å; L237-F252 PolarHBondContact N-O 3.42Å; L237-F252 PolarHBondContact O-N 2.87Å; L237-I537 CarbonylContact C-O 3.58Å; L237-I537 WeakPolarHBondContact CA-O 3.33Å; L237-I537 HydrophobicContact CD1-CB 4.21Å; L237-I537 HydrophobicContact CD1-CG2 3.87Å; L237-F539 HydrophobicContact CD1-CB 3.65Å; L237-F539 HydrophobicContact CD1-CG 4.46Å
238	R	94.6	Very high	90.3	Very high	55 Å²	55	37 Å²	37	21%	0.208	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	99.5	170.5	-65.2	-176.8	173.1	-131.1	-1.4	108.4	I251 I537 N538 F539	R238-I251 HydrophobicContact CG-CG1 4.36Å; R238-I251 HydrophobicContact CG-CG2 4.42Å; R238-I537 PolarHBondContact N-O 3.41Å; R238-N538 WeakPolarHBondContact CB-OD1 3.37Å; R238-F539 PolarHBondContact O-N 2.64Å
239	L	94.4	Very high	90.2	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	118.6	-176.6	-171.9	71.4	0	0	0	110.3	L224 A227 L237 V241 L250 F252 F539 I541	L224-L239 HydrophobicContact CD1-CD2 3.83Å; A227-L239 HydrophobicContact CB-CD1 4.25Å; L237-L239 HydrophobicContact CD2-CB 4.42Å; L239-V241 HydrophobicContact CD2-CG2 4.4Å; L239-V241 HydrophobicContact CG-CG2 4.45Å; L239-L250 HydrophobicContact CB-CB 4.31Å; L239-L250 PolarHBondContact N-O 3.2Å; L239-L250 PolarHBondContact O-N 3.03Å; L239-F252 HydrophobicContact CB-CD2 4.38Å; L239-F252 HydrophobicContact CB-CE2 3.94Å; L239-F252 HydrophobicContact CD2-CE2 3.78Å; L239-F252 HydrophobicContact CD2-CZ 4.25Å; L239-F539 WeakPolarHBondContact CA-O 3.5Å; L239-F539 HydrophobicContact CD1-CB 4.28Å; L239-F539 HydrophobicContact CD1-CD1 3.78Å; L239-F539 HydrophobicContact CD1-CG 4.45Å; L239-I541 HydrophobicContact CD1-CG2 3.67Å
240	T	93.3	Very high	90.2	Very high	10 Å²	10	40.7 Å²	40.7	6%	0.061	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	106.6	173.4	49.8	0	0	0	0	110	K249 F539 E540 I541	T240-K249 HydrophobicContact CG2-CD 3.75Å; T240-K249 HydrophobicContact CG2-CG 3.94Å; T240-F539 PolarHBondContact N-O 3.19Å; T240-F539 PolarHBondContact OG1-O 3.33Å; T240-E540 VanDerWaalsContact OG1-CA 3.26Å; T240-E540 WeakPolarHBondContact OG1-CA 3.48Å; T240-E540 WeakPolarHBondContact OG1-CB 3.23Å; T240-E540 WeakPolarHBondContact OG1-CG 3.49Å; T240-I541 WeakPolarHBondContact O-CG1 3.47Å; T240-I541 PolarHBondContact O-N 3.32Å
241	V	91.1	Very high	90.3	Very high	2 Å²	2	42.6 Å²	42.6	1%	0.012	22%	0.216	C	C	.	.			trans	-78.4	-25.7	-170.8	-177.2	0	0	0	0	112.8	W220 L239 L250 I541	W220-V241 HydrophobicContact CH2-CG1 4.35Å; W220-V241 HydrophobicContact CZ2-CG1 3.57Å; W220-V241 PolarHBondContact NE1-O 3.41Å; L239-V241 HydrophobicContact CD2-CG2 4.4Å; L239-V241 HydrophobicContact CG-CG2 4.45Å; V241-L250 HydrophobicContact CG2-CD1 3.64Å; V241-L250 HydrophobicContact CG2-CG 3.76Å; V241-I541 HydrophobicContact CB-CD1 4.36Å; V241-I541 HydrophobicContact CG1-CD1 4.12Å
242	G	88.7	Confident	90.5	Very high	4 Å²	4	41.9 Å²	41.9	4%	0.041	21%	0.213	C	C	.	.	S	Bend	trans	-169	-162.1	176.7	0	0	0	0	0	110.1	E244 W542	G242-E244 PolarHBondContact O-N 3.23Å; G242-W542 VanDerWaalsContact C-CE2 3.44Å; G242-W542 VanDerWaalsContact CA-CD1 3.42Å; G242-W542 PolarHBondContact O-NE1 3.47Å; G242-W542 VanDerWaalsContact O-NE1 3.1Å
243	P	86.2	Confident	90.7	Very high	6 Å²	6	40.5 Å²	40.5	4%	0.039	20%	0.204	C	C	.	.			trans	-58.2	135.9	175.6	-23.2	33.8	0	0	0	111.9	T245 L246 Y247 W542 T547 Y550	P243-T245 PolarHBondContact O-N 2.82Å; P243-L246 PolarHBondContact O-N 3.27Å; P243-Y247 PolarHBondContact O-N 3.18Å; P243-W542 HydrophobicContact CB-CH2 4.41Å; P243-W542 HydrophobicContact CB-CZ2 4.36Å; P243-W542 HydrophobicContact CG-CH2 3.98Å; P243-W542 HydrophobicContact CG-CZ2 4.14Å; P243-W542 HydrophobicContact CG-CZ3 4.2Å; P243-T547 HydrophobicContact CB-CG2 4.22Å; P243-T547 HydrophobicContact CG-CG2 3.98Å; P243-Y550 HydrophobicContact CG-CD2 4.48Å
244	E	83.2	Confident	90.9	Very high	134 Å²	134	39.5 Å²	39.5	63%	0.626	19%	0.192	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.6	-19.1	-177.5	-61.7	-175.2	-173.9	0	0	113.7	G242 L246 K249	G242-E244 PolarHBondContact O-N 3.23Å; E244-L246 VanDerWaalsContact C-N 3.26Å; E244-L246 PolarHBondContact O-N 2.84Å; E244-K249 WeakPolarHBondContact OE1-CE 3.38Å; E244-K249 IonicContact OE1-NZ 3.95Å; E244-K249 PolarHBondContact OE1-NZ 3.5Å
245	T	83.9	Confident	91	Very high	112 Å²	112	34.4 Å²	34.4	69%	0.687	17%	0.172	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.7	-13.9	174.3	56.5	0	0	0	0	113.7	P243	P243-T245 PolarHBondContact O-N 2.82Å
246	L	83.6	Confident	91	Very high	53 Å²	53	37.1 Å²	37.1	28%	0.277	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	-119.6	-36.1	-177.5	-60.2	-177.2	0	0	0	112.4	P243 E244 L551 N554	P243-L246 PolarHBondContact O-N 3.27Å; E244-L246 VanDerWaalsContact C-N 3.26Å; E244-L246 PolarHBondContact O-N 2.84Å; L246-L551 HydrophobicContact CD1-CD2 4.15Å; L246-L551 HydrophobicContact CD2-CD2 4.43Å; L246-L551 HydrophobicContact CG-CD2 4.2Å; L246-N554 HydrophobicContact CD1-CB 4.33Å; L246-N554 HydrophobicContact CD2-CB 4.42Å; L246-N554 VanDerWaalsContact CD2-ND2 3.29Å; L246-N554 WeakPolarHBondContact CD2-ND2 3.47Å
247	Y	87.9	Confident	90.8	Very high	25 Å²	25	40.8 Å²	40.8	10%	0.098	20%	0.202	C	C	.	.			trans	-128.8	130	-171.9	-60.1	-75.7	0	0	0	111.8	E169 R173 P243	E169-Y247 WeakPolarHBondContact OE2-CE1 3.19Å; E169-Y247 PolarHBondContact OE2-OH 2.95Å; R173-Y247 PolarHBondContact NH1-OH 2.79Å; P243-Y247 PolarHBondContact O-N 3.18Å
248	E	87.8	Confident	90.7	Very high	162 Å²	162	42.3 Å²	42.3	76%	0.757	21%	0.212	S	C	*	.	P	Polyproline II helix	trans	-70.7	153.1	170.9	-171.8	170.8	-175.2	0	0	111.3	L250	E248-L250 PolarHBondContact O-N 2.65Å
249	K	90.3	Very high	90.7	Very high	75 Å²	75	41.1 Å²	41.1	33%	0.326	21%	0.207	S	C	.	.	P	Polyproline II helix	trans	-76.1	123.4	178.4	-54.5	-164.6	179.8	-174.5	0	110.5	T240 E244 I251	T240-K249 HydrophobicContact CG2-CD 3.75Å; T240-K249 HydrophobicContact CG2-CG 3.94Å; E244-K249 WeakPolarHBondContact OE1-CE 3.38Å; E244-K249 IonicContact OE1-NZ 3.95Å; E244-K249 PolarHBondContact OE1-NZ 3.5Å; K249-I251 PolarHBondContact O-N 3.33Å
250	L	94.1	Very high	90.8	Very high	12 Å²	12	41.1 Å²	41.1	6%	0.063	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	120	177.6	-53.8	-173.4	0	0	0	109.9	Q162 C163 L239 V241 E248 F252	Q162-L250 HydrophobicContact CB-CD1 4.28Å; Q162-L250 HydrophobicContact CB-CD2 4.32Å; C163-L250 WeakPolarHBondContact SG-CD1 3.43Å; L239-L250 HydrophobicContact CB-CB 4.31Å; L239-L250 PolarHBondContact N-O 3.2Å; L239-L250 PolarHBondContact O-N 3.03Å; V241-L250 HydrophobicContact CG2-CD1 3.64Å; V241-L250 HydrophobicContact CG2-CG 3.76Å; E248-L250 PolarHBondContact O-N 2.65Å; L250-F252 HydrophobicContact CB-CD2 4.48Å; L250-F252 HydrophobicContact CB-CE2 3.73Å; L250-F252 HydrophobicContact CB-CZ 4.33Å
251	I	94.2	Very high	90.7	Very high	41 Å²	41	44.1 Å²	44.1	21%	0.21	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	118.4	-179.4	-46.9	-179.1	0	0	0	110.7	K159 C236 L237 R238 K249	K159-I251 WeakPolarHBondContact CD-O 3.12Å; K159-I251 WeakPolarHBondContact CE-O 3.41Å; K159-I251 PolarHBondContact NZ-O 2.96Å; C236-I251 HydrophobicContact CB-CG2 4.31Å; L237-I251 CarbonylContact O-C 3.59Å; L237-I251 VanDerWaalsContact O-CA 3.31Å; L237-I251 WeakPolarHBondContact O-CA 3.08Å; R238-I251 HydrophobicContact CG-CG1 4.36Å; R238-I251 HydrophobicContact CG-CG2 4.42Å; K249-I251 PolarHBondContact O-N 3.33Å
252	F	95.4	Very high	90.9	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	130.1	174.4	-55.4	-105.4	0	0	0	109.6	L14 F156 K159 F160 P230 C236 L237 L239 L250	L14-F252 HydrophobicContact CD1-CD1 3.93Å; L14-F252 HydrophobicContact CD1-CE1 4.34Å; L14-F252 HydrophobicContact CD1-CG 4.32Å; L14-F252 HydrophobicContact CD2-CD1 4.21Å; L14-F252 HydrophobicContact CD2-CD2 4.32Å; L14-F252 HydrophobicContact CD2-CE1 4.07Å; L14-F252 HydrophobicContact CD2-CE2 4.18Å; L14-F252 HydrophobicContact CD2-CG 4.33Å; L14-F252 HydrophobicContact CD2-CZ 4.05Å; F156-F252 HydrophobicContact CB-CD1 3.96Å; F156-F252 HydrophobicContact CB-CE1 3.88Å; F156-F252 AromaticContact CD1-CD1 3.88Å; F156-F252 HydrophobicContact CD1-CD1 3.88Å; F156-F252 AromaticContact CD2-CD1 3.69Å; F156-F252 HydrophobicContact CD2-CD1 3.69Å; F156-F252 HydrophobicContact CD2-CE1 4.28Å; F156-F252 HydrophobicContact CE1-CB 4.32Å; F156-F252 HydrophobicContact CE1-CD1 4.18Å; F156-F252 HydrophobicContact CE2-CB 4.4Å; F156-F252 HydrophobicContact CE2-CD1 4.01Å; F156-F252 AromaticContact CG-CD1 3.6Å; F156-F252 HydrophobicContact CG-CD1 3.6Å; F156-F252 HydrophobicContact CG-CE1 4.05Å; F156-F252 HydrophobicContact CZ-CB 4.08Å; F156-F252 HydrophobicContact CZ-CD1 4.22Å; K159-F252 HydrophobicContact CB-CD1 4.28Å; K159-F252 HydrophobicContact CB-CE1 3.48Å; K159-F252 VanDerWaalsContact CB-CE1 3.48Å; K159-F252 HydrophobicContact CB-CE2 4.48Å; K159-F252 HydrophobicContact CB-CZ 3.61Å; K159-F252 HydrophobicContact CD-CD1 3.86Å; K159-F252 HydrophobicContact CD-CE1 3.94Å; K159-F252 HydrophobicContact CD-CG 4.26Å; K159-F252 HydrophobicContact CD-CZ 4.4Å; K159-F252 HydrophobicContact CG-CE1 4.31Å; F160-F252 AromaticContact CD1-CE1 3.96Å; F160-F252 HydrophobicContact CD1-CE1 3.96Å; F160-F252 HydrophobicContact CD1-CZ 4.32Å; F160-F252 AromaticContact CE1-CE1 3.61Å; F160-F252 HydrophobicContact CE1-CE1 3.61Å; F160-F252 HydrophobicContact CE1-CZ 4.16Å; F160-F252 HydrophobicContact CZ-CE1 4.37Å; P230-F252 HydrophobicContact CG-CB 4.04Å; C236-F252 CarbonylContact C-O 3.12Å; C236-F252 WeakPolarHBondContact CA-O 3.49Å; L237-F252 HydrophobicContact CB-CB 4.21Å; L237-F252 HydrophobicContact CD2-CB 4.48Å; L237-F252 HydrophobicContact CD2-CD2 3.85Å; L237-F252 HydrophobicContact CD2-CE2 4.44Å; L237-F252 HydrophobicContact CD2-CG 4.36Å; L237-F252 HydrophobicContact CG-CD2 4.44Å; L237-F252 PolarHBondContact N-O 3.42Å; L237-F252 PolarHBondContact O-N 2.87Å; L239-F252 HydrophobicContact CB-CD2 4.38Å; L239-F252 HydrophobicContact CB-CE2 3.94Å; L239-F252 HydrophobicContact CD2-CE2 3.78Å; L239-F252 HydrophobicContact CD2-CZ 4.25Å; L250-F252 HydrophobicContact CB-CD2 4.48Å; L250-F252 HydrophobicContact CB-CE2 3.73Å; L250-F252 HydrophobicContact CB-CZ 4.33Å
253	A	94.2	Very high	91.1	Very high	2 Å²	2	45.4 Å²	45.4	2%	0.017	23%	0.231	C	C	.	.			trans	-146.9	148.8	174.9	0	0	0	0	0	107.8	F156 C236 Y530 L534	F156-A253 WeakPolarHBondContact CE1-O 3.46Å; C236-A253 HydrophobicContact CB-CB 4.07Å; A253-Y530 HydrophobicContact CB-CE2 3.84Å; A253-L534 HydrophobicContact CB-CD1 4.06Å
254	L	93.6	Very high	91.4	Very high	8 Å²	8	45.9 Å²	45.9	4%	0.042	23%	0.233	C	C	.	.			trans	-116.1	135.6	177	-74.8	164.4	0	0	0	109.9	Y10 F156 V229 P230 P232 G233 L262 Y530	Y10-L254 HydrophobicContact CE1-CD1 3.83Å; Y10-L254 WeakPolarHBondContact OH-CD1 3.47Å; F156-L254 HydrophobicContact CE1-CD2 4.38Å; F156-L254 HydrophobicContact CE2-CD2 4.22Å; F156-L254 HydrophobicContact CE2-CG 4.37Å; F156-L254 HydrophobicContact CZ-CD1 4.44Å; F156-L254 HydrophobicContact CZ-CD2 3.7Å; F156-L254 HydrophobicContact CZ-CG 3.79Å; V229-L254 HydrophobicContact CG2-CD1 3.87Å; P230-L254 HydrophobicContact CG-CD1 4.19Å; P230-L254 HydrophobicContact CG-CG 4.2Å; P230-L254 WeakPolarHBondContact O-CD1 3.41Å; P232-L254 WeakPolarHBondContact CA-O 3.16Å; P232-L254 HydrophobicContact CB-CB 4.21Å; P232-L254 HydrophobicContact CG-CB 3.9Å; P232-L254 HydrophobicContact CG-CD1 4.29Å; G233-L254 PolarHBondContact N-O 3.29Å; L254-L262 HydrophobicContact CD2-CD2 3.74Å; L254-Y530 VanDerWaalsContact C-OH 3.31Å
255	P	93.6	Very high	91.9	Very high	20 Å²	20	40.7 Å²	40.7	13%	0.13	21%	0.209	C	C	.	.			trans	-68.1	151.4	175	28.6	-32.5	0	0	0	110.3	R259 L260 L262 D525 Y530	P255-R259 HydrophobicContact CB-CB 3.7Å; P255-L260 WeakPolarHBondContact CB-O 3.31Å; P255-L260 VanDerWaalsContact CG-O 3.31Å; P255-L260 WeakPolarHBondContact CG-O 3.22Å; P255-L262 HydrophobicContact CG-CB 4.1Å; P255-D525 HydrophobicContact CG-CB 4.44Å; P255-Y530 WeakPolarHBondContact CD-OH 3.34Å; P255-Y530 VanDerWaalsContact N-OH 3.1Å
256	D	91.9	Very high	92.3	Very high	58 Å²	58	37.5 Å²	37.5	31%	0.31	19%	0.19	S	C	.	.			trans	-95.4	-175.3	171.9	61.8	15.1	0	0	0	111.6	T258 R259	D256-T258 PolarHBondContact O-N 2.91Å; D256-T258 WeakPolarHBondContact OD1-CA 3.35Å; D256-T258 VanDerWaalsContact OD1-CB 3.28Å; D256-T258 WeakPolarHBondContact OD1-CB 3.48Å; D256-T258 PolarHBondContact OD1-N 3.15Å; D256-T258 PolarHBondContact OD1-OG1 3.22Å; D256-R259 PolarHBondContact O-N 3.21Å; D256-R259 VanDerWaalsContact O-N 3.13Å
257	K	90.9	Very high	92.8	Very high	77 Å²	77	35 Å²	35	34%	0.335	18%	0.177	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.7	-12.7	177.6	-62.5	-171.7	-178.8	-177.7	0	113.3	D6 R259 Y504 N507 E508	D6-K257 VanDerWaalsContact CG-NZ 3.28Å; D6-K257 WeakPolarHBondContact OD1-CE 3.47Å; D6-K257 IonicContact OD1-NZ 2.74Å; D6-K257 PolarHBondContact OD1-NZ 3.14Å; D6-K257 IonicContact OD2-NZ 3.58Å; D6-K257 PolarHBondContact OD2-NZ 2.82Å; K257-R259 VanDerWaalsContact C-N 3.34Å; K257-Y504 PolarHBondContact NZ-OH 3.45Å; K257-N507 CarbonylContact O-C 3.56Å; K257-N507 VanDerWaalsContact O-CA 3.26Å; K257-N507 WeakPolarHBondContact O-CA 3.31Å; K257-N507 WeakPolarHBondContact O-CB 3.21Å; K257-E508 PolarHBondContact O-N 2.9Å
258	T	92.6	Very high	92.9	Very high	33 Å²	33	34.4 Å²	34.4	20%	0.202	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.7	-9.6	179.5	77.9	0	0	0	0	114.1	D256 V509 R512	D256-T258 PolarHBondContact O-N 2.91Å; D256-T258 WeakPolarHBondContact OD1-CA 3.35Å; D256-T258 VanDerWaalsContact OD1-CB 3.28Å; D256-T258 WeakPolarHBondContact OD1-CB 3.48Å; D256-T258 PolarHBondContact OD1-N 3.15Å; D256-T258 PolarHBondContact OD1-OG1 3.22Å; T258-V509 WeakPolarHBondContact O-CG2 3.33Å; T258-R512 PolarHBondContact O-NH1 2.96Å
259	R	94.7	Very high	93.2	Very high	29 Å²	29	27.8 Å²	27.8	11%	0.109	15%	0.145	C	C	.	.	S	Bend	trans	-126.3	166.3	-169.8	-73.6	172.4	-178.7	-76.6	-8.9	112.2	P255 D256 K257 V509 E521 G524	P255-R259 HydrophobicContact CB-CB 3.7Å; D256-R259 PolarHBondContact O-N 3.21Å; D256-R259 VanDerWaalsContact O-N 3.13Å; K257-R259 VanDerWaalsContact C-N 3.34Å; R259-V509 VanDerWaalsContact CA-CG2 3.48Å; R259-E521 VanDerWaalsContact CZ-O 3.3Å; R259-E521 PolarHBondContact NH1-O 3.32Å; R259-E521 PolarHBondContact NH2-O 3.12Å; R259-G524 WeakPolarHBondContact CD-O 3.45Å; R259-G524 PolarHBondContact NH1-O 2.79Å
260	L	94.8	Very high	93.4	Very high	1 Å²	1	24.2 Å²	24.2	1%	0.005	13%	0.129	C	C	.	.	P	Polyproline II helix	trans	-65.2	152.7	175.2	-71.2	166.5	0	0	0	110.3	P255 Y314 V434 R437 V509 I523 D525	P255-L260 WeakPolarHBondContact CB-O 3.31Å; P255-L260 VanDerWaalsContact CG-O 3.31Å; P255-L260 WeakPolarHBondContact CG-O 3.22Å; L260-Y314 HydrophobicContact CD2-CD1 4.17Å; L260-Y314 HydrophobicContact CD2-CE1 3.66Å; L260-V434 HydrophobicContact CD1-CG1 4.2Å; L260-V434 HydrophobicContact CD1-CG2 4.32Å; L260-R437 HydrophobicContact CD1-CB 4.5Å; L260-V509 HydrophobicContact CD2-CB 3.96Å; L260-V509 HydrophobicContact CD2-CG1 3.62Å; L260-V509 HydrophobicContact CD2-CG2 4.37Å; L260-V509 HydrophobicContact CG-CB 4.27Å; L260-V509 HydrophobicContact CG-CG1 3.85Å; L260-V509 HydrophobicContact CG-CG2 4.18Å; L260-I523 WeakPolarHBondContact CG-O 3.26Å; L260-I523 PolarHBondContact N-O 2.95Å; L260-D525 HydrophobicContact CB-CB 4.1Å; L260-D525 VanDerWaalsContact O-CB 3.23Å; L260-D525 WeakPolarHBondContact O-CB 3.34Å
261	T	92.2	Very high	93.4	Very high	72 Å²	72	24 Å²	24	44%	0.442	13%	0.128	S	C	.	.	P	Polyproline II helix	trans	-60.2	144.2	172.4	48.2	0	0	0	0	111	I263 R437 D525	T261-I263 PolarHBondContact O-N 3.48Å; T261-R437 PolarHBondContact O-NH1 3.45Å; T261-R437 VanDerWaalsContact O-NH1 3.11Å; T261-D525 VanDerWaalsContact O-CB 3.31Å; T261-D525 WeakPolarHBondContact O-CB 3.24Å
262	L	94.4	Very high	93.2	Very high	27 Å²	27	28.6 Å²	28.6	14%	0.141	15%	0.149	C	C	.	.	P	Polyproline II helix	trans	-66.2	123.1	-177.6	179.4	64.5	0	0	0	111.2	P155 F156 L254 P255	P155-L262 HydrophobicContact CG-CD2 4.36Å; F156-L262 HydrophobicContact CD1-CD2 3.76Å; F156-L262 HydrophobicContact CE1-CD2 3.46Å; F156-L262 VanDerWaalsContact CE1-CD2 3.46Å; F156-L262 HydrophobicContact CZ-CD2 4.06Å; L254-L262 HydrophobicContact CD2-CD2 3.74Å; P255-L262 HydrophobicContact CG-CB 4.1Å
263	I	93.5	Very high	93.2	Very high	6 Å²	6	31 Å²	31	3%	0.031	16%	0.161	C	C	.	.			trans	-121.5	112.7	172.3	-69.2	177.2	0	0	0	107.2	T261 F265 L267 A311 D525 K526	T261-I263 PolarHBondContact O-N 3.48Å; I263-F265 HydrophobicContact CB-CE1 4.43Å; I263-F265 HydrophobicContact CB-CZ 4.38Å; I263-F265 HydrophobicContact CG1-CZ 4.22Å; I263-F265 HydrophobicContact CG2-CD1 3.94Å; I263-F265 HydrophobicContact CG2-CD2 3.71Å; I263-F265 HydrophobicContact CG2-CE1 3.86Å; I263-F265 HydrophobicContact CG2-CE2 3.59Å; I263-F265 HydrophobicContact CG2-CG 3.89Å; I263-F265 HydrophobicContact CG2-CZ 3.68Å; I263-F265 WeakPolarHBondContact CG2-O 3.39Å; I263-L267 HydrophobicContact CD1-CD1 4.34Å; I263-A311 HydrophobicContact CD1-CB 3.65Å; I263-A311 HydrophobicContact CG1-CB 4.43Å; I263-D525 PolarHBondContact N-OD2 2.72Å; I263-K526 WeakPolarHBondContact O-CE 3.41Å; I263-K526 PolarHBondContact O-NZ 2.7Å
264	D	93.7	Very high	93.2	Very high	17 Å²	17	31 Å²	31	9%	0.091	16%	0.161	C	C	.	.			trans	-106.4	47.2	176.1	-161.1	7.8	0	0	0	111.2	P155 F156 F157 S158	P155-D264 WeakPolarHBondContact O-CB 3.28Å; F156-D264 VanDerWaalsContact CA-OD2 3.31Å; F156-D264 WeakPolarHBondContact CA-OD2 3.31Å; F157-D264 HydrophobicContact CB-CB 4.49Å; F157-D264 PolarHBondContact N-OD2 3.49Å; S158-D264 WeakPolarHBondContact CB-OD1 3.19Å; S158-D264 PolarHBondContact N-OD2 3.34Å; S158-D264 PolarHBondContact OG-OD1 2.93Å
265	F	93.2	Very high	93.2	Very high	24 Å²	24	31.9 Å²	31.9	11%	0.105	17%	0.172	C	C	.	.	S	Bend	trans	-153.9	149.5	177.8	51.3	-92.3	0	0	0	110.4	F157 I263 L267 M304 M307 A308 A311	F157-F265 HydrophobicContact CD2-CB 4.39Å; F157-F265 AromaticContact CD2-CD1 3.82Å; F157-F265 HydrophobicContact CD2-CD1 3.82Å; F157-F265 AromaticContact CE2-CD1 3.5Å; F157-F265 HydrophobicContact CE2-CD1 3.5Å; F157-F265 VanDerWaalsContact CE2-CD1 3.5Å; F157-F265 AromaticContact CE2-CE1 3.97Å; F157-F265 HydrophobicContact CE2-CE1 3.97Å; I263-F265 HydrophobicContact CB-CE1 4.43Å; I263-F265 HydrophobicContact CB-CZ 4.38Å; I263-F265 HydrophobicContact CG1-CZ 4.22Å; I263-F265 HydrophobicContact CG2-CD1 3.94Å; I263-F265 HydrophobicContact CG2-CD2 3.71Å; I263-F265 HydrophobicContact CG2-CE1 3.86Å; I263-F265 HydrophobicContact CG2-CE2 3.59Å; I263-F265 HydrophobicContact CG2-CG 3.89Å; I263-F265 HydrophobicContact CG2-CZ 3.68Å; I263-F265 WeakPolarHBondContact CG2-O 3.39Å; F265-L267 PolarHBondContact O-N 3.1Å; F265-L267 VanDerWaalsContact O-N 3.1Å; F265-M304 HydrophobicContact CB-CG 4.41Å; F265-M304 HydrophobicContact CB-SD 3.38Å; F265-M304 WeakPolarHBondContact CB-SD 3.33Å; F265-M304 HydrophobicContact CG-SD 4.24Å; F265-M307 HydrophobicContact CD1-CE 4.38Å; F265-M307 HydrophobicContact CD2-CB 4.23Å; F265-M307 HydrophobicContact CE1-CB 4.07Å; F265-M307 HydrophobicContact CE2-CB 3.77Å; F265-M307 HydrophobicContact CZ-CB 3.66Å; F265-A308 HydrophobicContact CD2-CB 4.39Å; F265-A308 HydrophobicContact CE2-CB 4.32Å; F265-A311 HydrophobicContact CE2-CB 4.26Å; F265-A311 HydrophobicContact CZ-CB 4.21Å
266	P	92.1	Very high	93.1	Very high	46 Å²	46	32.4 Å²	32.4	30%	0.299	17%	0.173	S	C	.	.			trans	-67.5	109.2	-176.6	26.8	-34.9	0	0	0	111.2	H268 L269	P266-H268 VanDerWaalsContact C-N 3.27Å; P266-H268 VanDerWaalsContact CB-CE1 3.43Å; P266-H268 WeakPolarHBondContact CB-CE1 3.47Å; P266-H268 PolarHBondContact O-N 2.86Å; P266-L269 HydrophobicContact CB-CB 4.21Å; P266-L269 HydrophobicContact CG-CB 3.98Å; P266-L269 HydrophobicContact CG-CD2 4.26Å; P266-L269 WeakPolarHBondContact O-CB 3.3Å; P266-L269 PolarHBondContact O-N 3.44Å
267	L	93.2	Very high	93.1	Very high	0 Å²	0	36 Å²	36	0%	0	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-32.1	-179.4	-168.2	66.9	0	0	0	111.8	I263 F265 L269 P270 A308 A311 M312 D433 T436 R437	I263-L267 HydrophobicContact CD1-CD1 4.34Å; F265-L267 PolarHBondContact O-N 3.1Å; F265-L267 VanDerWaalsContact O-N 3.1Å; L267-L269 VanDerWaalsContact C-N 3.28Å; L267-L269 PolarHBondContact O-N 3.49Å; L267-P270 WeakPolarHBondContact O-CD 3.49Å; L267-A308 HydrophobicContact CD1-CB 4.15Å; L267-A308 WeakPolarHBondContact CD1-O 3.41Å; L267-A311 HydrophobicContact CD1-CB 3.73Å; L267-M312 HydrophobicContact CD1-CG 3.67Å; L267-M312 HydrophobicContact CD2-CG 4.13Å; L267-M312 HydrophobicContact CG-CG 3.72Å; L267-M312 WeakPolarHBondContact O-CE 3.47Å; L267-D433 HydrophobicContact CB-CB 3.82Å; L267-D433 WeakPolarHBondContact CB-OD1 3.29Å; L267-D433 HydrophobicContact CD2-CB 4.46Å; L267-D433 WeakPolarHBondContact CD2-O 3.34Å; L267-D433 VanDerWaalsContact N-CG 3.32Å; L267-D433 PolarHBondContact N-OD1 2.96Å; L267-D433 PolarHBondContact N-OD2 3.4Å; L267-T436 HydrophobicContact CD2-CG2 3.88Å; L267-T436 HydrophobicContact CG-CG2 4.31Å; L267-R437 HydrophobicContact CD2-CG 3.59Å
268	H	91	Very high	93.3	Very high	13 Å²	13	33.6 Å²	33.6	6%	0.06	18%	0.179	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.8	-12.8	177.3	58.2	-86.5	0	0	0	115	P266 L271 E272 L402 M405 D433	P266-H268 VanDerWaalsContact C-N 3.27Å; P266-H268 VanDerWaalsContact CB-CE1 3.43Å; P266-H268 WeakPolarHBondContact CB-CE1 3.47Å; P266-H268 PolarHBondContact O-N 2.86Å; H268-L271 WeakPolarHBondContact O-CA 3.4Å; H268-L271 VanDerWaalsContact O-CB 3.31Å; H268-L271 WeakPolarHBondContact O-CB 3.27Å; H268-L271 PolarHBondContact O-N 3.15Å; H268-E272 PolarHBondContact O-N 2.99Å; H268-L402 HydrophobicContact CB-CD2 3.71Å; H268-M405 WeakPolarHBondContact NE2-CE 3.49Å; H268-D433 IonicContact CE1-OD1 3.91Å; H268-D433 IonicContact CG-OD1 2.62Å; H268-D433 PolarHBondContact N-OD1 3.29Å; H268-D433 IonicContact ND1-OD1 2.64Å; H268-D433 PolarHBondContact ND1-OD1 3.16Å
269	L	93	Very high	93.5	Very high	23 Å²	23	32 Å²	32	12%	0.12	17%	0.17	C	C	.	.	H	α-helix	trans	-55.9	-41.3	-171.8	179.1	66.9	0	0	0	114.7	P266 L267 L271 E272 L273 M304	P266-L269 HydrophobicContact CB-CB 4.21Å; P266-L269 HydrophobicContact CG-CB 3.98Å; P266-L269 HydrophobicContact CG-CD2 4.26Å; P266-L269 WeakPolarHBondContact O-CB 3.3Å; P266-L269 PolarHBondContact O-N 3.44Å; L267-L269 VanDerWaalsContact C-N 3.28Å; L267-L269 PolarHBondContact O-N 3.49Å; L269-L271 VanDerWaalsContact C-N 3.26Å; L269-L271 PolarHBondContact O-N 2.78Å; L269-E272 WeakPolarHBondContact O-CB 3.41Å; L269-E272 PolarHBondContact O-N 3.06Å; L269-E272 VanDerWaalsContact O-N 3.15Å; L269-L273 HydrophobicContact CD1-CD1 3.96Å; L269-L273 HydrophobicContact CD1-CD2 4.46Å; L269-L273 HydrophobicContact CD1-CG 3.99Å; L269-L273 HydrophobicContact CD2-CD1 4.41Å; L269-L273 HydrophobicContact CG-CD1 3.87Å; L269-L273 HydrophobicContact CG-CG 4.29Å; L269-L273 WeakPolarHBondContact O-CG 3.49Å; L269-L273 PolarHBondContact O-N 3.3Å; L269-M304 HydrophobicContact CD2-CB 3.77Å
270	P	95.3	Very high	93.5	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-64.2	-29.6	175.9	-23.8	36.2	0	0	0	113.7	L267 L274 A308 F309 M312	L267-P270 WeakPolarHBondContact O-CD 3.49Å; P270-L274 VanDerWaalsContact O-CB 3.28Å; P270-L274 WeakPolarHBondContact O-CB 3.43Å; P270-L274 PolarHBondContact O-N 3.15Å; P270-A308 HydrophobicContact CG-CB 3.69Å; P270-F309 HydrophobicContact CB-CD2 4.25Å; P270-F309 HydrophobicContact CB-CE1 4.16Å; P270-F309 HydrophobicContact CB-CE2 3.61Å; P270-F309 HydrophobicContact CB-CZ 3.56Å; P270-F309 HydrophobicContact CG-CD2 4.18Å; P270-F309 HydrophobicContact CG-CE2 4.02Å; P270-F309 HydrophobicContact CG-CZ 4.34Å; P270-M312 HydrophobicContact CB-CE 4.01Å; P270-M312 HydrophobicContact CG-CE 3.67Å
271	L	93.1	Very high	93.5	Very high	7 Å²	7	35 Å²	35	4%	0.037	18%	0.184	C	C	.	.	H	α-helix	trans	-70.3	-34	175.2	-64	162.4	0	0	0	111.1	H268 L269 G275 M276 C279 L398 L402	H268-L271 WeakPolarHBondContact O-CA 3.4Å; H268-L271 VanDerWaalsContact O-CB 3.31Å; H268-L271 WeakPolarHBondContact O-CB 3.27Å; H268-L271 PolarHBondContact O-N 3.15Å; L269-L271 VanDerWaalsContact C-N 3.26Å; L269-L271 PolarHBondContact O-N 2.78Å; L271-G275 WeakPolarHBondContact O-CA 3.4Å; L271-G275 PolarHBondContact O-N 2.61Å; L271-M276 HydrophobicContact CD2-CE 4.23Å; L271-M276 HydrophobicContact CD2-SD 3.71Å; L271-C279 HydrophobicContact CD2-CB 3.85Å; L271-C279 VanDerWaalsContact CD2-SG 3.57Å; L271-L398 HydrophobicContact CD1-CD2 4.4Å; L271-L398 HydrophobicContact CD2-CD1 4.37Å; L271-L402 HydrophobicContact CB-CD1 3.98Å; L271-L402 HydrophobicContact CB-CD2 4.25Å; L271-L402 HydrophobicContact CD1-CD1 4.25Å; L271-L402 HydrophobicContact CD1-CD2 4.29Å; L271-L402 HydrophobicContact CD1-CG 4.49Å
272	E	90.9	Very high	93.8	Very high	138 Å²	138	31.6 Å²	31.6	65%	0.645	16%	0.163	S	C	*	.	H	α-helix	trans	-69.5	-47.5	174.3	-171.9	-178.2	172.6	0	0	111.7	H268 L269	H268-E272 PolarHBondContact O-N 2.99Å; L269-E272 WeakPolarHBondContact O-CB 3.41Å; L269-E272 PolarHBondContact O-N 3.06Å; L269-E272 VanDerWaalsContact O-N 3.15Å
273	L	94.9	Very high	93.9	Very high	51 Å²	51	30.6 Å²	30.6	27%	0.267	16%	0.158	S	C	.	.	H	α-helix	trans	-73.7	-40.5	-175.7	-63.4	174.7	0	0	0	113.3	L269 A301 L369	L269-L273 HydrophobicContact CD1-CD1 3.96Å; L269-L273 HydrophobicContact CD1-CD2 4.46Å; L269-L273 HydrophobicContact CD1-CG 3.99Å; L269-L273 HydrophobicContact CD2-CD1 4.41Å; L269-L273 HydrophobicContact CG-CD1 3.87Å; L269-L273 HydrophobicContact CG-CG 4.29Å; L269-L273 WeakPolarHBondContact O-CG 3.49Å; L269-L273 PolarHBondContact O-N 3.3Å; L273-A301 HydrophobicContact CD1-CB 4.03Å; L273-L369 HydrophobicContact CB-CD2 4.42Å; L273-L369 HydrophobicContact CD1-CD2 4.32Å
274	L	95.6	Very high	94	Very high	1 Å²	1	30.6 Å²	30.6	1%	0.005	16%	0.158	C	C	.	.	H	α-helix	trans	-101.2	-11.7	-176.4	-62.1	177.1	0	0	0	113.3	P270 T278 C279 V282 F309 V367 L369 N372	P270-L274 VanDerWaalsContact O-CB 3.28Å; P270-L274 WeakPolarHBondContact O-CB 3.43Å; P270-L274 PolarHBondContact O-N 3.15Å; L274-T278 HydrophobicContact CB-CG2 4.19Å; L274-T278 HydrophobicContact CD2-CG2 4.16Å; L274-T278 VanDerWaalsContact O-CB 3.32Å; L274-T278 WeakPolarHBondContact O-CB 3.38Å; L274-T278 PolarHBondContact O-OG1 3.44Å; L274-C279 HydrophobicContact CB-CB 4.15Å; L274-V282 HydrophobicContact CD1-CG2 4.2Å; L274-F309 HydrophobicContact CD1-CE2 4.24Å; L274-F309 HydrophobicContact CD1-CZ 3.91Å; L274-V367 HydrophobicContact CD1-CG1 3.89Å; L274-V367 HydrophobicContact CD2-CG1 4.11Å; L274-L369 HydrophobicContact CD1-CD2 3.95Å; L274-L369 HydrophobicContact CD2-CD2 3.98Å; L274-L369 HydrophobicContact CG-CD2 3.85Å; L274-N372 WeakPolarHBondContact CA-OD1 3.22Å; L274-N372 PolarHBondContact O-ND2 3.38Å; L274-N372 PolarHBondContact O-OD1 3.3Å
275	G	92.5	Very high	94.2	Very high	26 Å²	26	29.8 Å²	29.8	27%	0.268	15%	0.154	S	C	.	.	H	α-helix	trans	64.3	168.8	-168.4	0	0	0	0	0	112.6	L271 E277 C279	L271-G275 WeakPolarHBondContact O-CA 3.4Å; L271-G275 PolarHBondContact O-N 2.61Å; G275-E277 PolarHBondContact O-N 3.05Å; G275-C279 WeakPolarHBondContact O-CB 3.14Å; G275-C279 PolarHBondContact O-N 3.23Å
276	M	91.8	Very high	94.4	Very high	31 Å²	31	28.8 Å²	28.8	15%	0.153	15%	0.15	C	C	.	.	H	α-helix	trans	-57.8	-49	-172.3	-163	60.4	69.4	0	0	113.4	L271 L280 C395 L398 D399 L402	L271-M276 HydrophobicContact CD2-CE 4.23Å; L271-M276 HydrophobicContact CD2-SD 3.71Å; M276-L280 HydrophobicContact CG-CD1 4Å; M276-L280 WeakPolarHBondContact O-CB 3.46Å; M276-L280 VanDerWaalsContact O-CG 3.32Å; M276-L280 WeakPolarHBondContact O-CG 3.3Å; M276-L280 PolarHBondContact O-N 2.73Å; M276-L280 HydrophobicContact SD-CD1 4.14Å; M276-L280 HydrophobicContact SD-CG 4.34Å; M276-C395 HydrophobicContact CG-CB 4.31Å; M276-L398 HydrophobicContact CE-CB 3.44Å; M276-L398 VanDerWaalsContact CE-CB 3.44Å; M276-L398 HydrophobicContact CE-CD1 4.47Å; M276-L398 HydrophobicContact SD-CB 3.82Å; M276-L398 HydrophobicContact SD-CD1 3.74Å; M276-L398 HydrophobicContact SD-CG 4.45Å; M276-D399 HydrophobicContact CE-CB 4.49Å; M276-D399 WeakPolarHBondContact CE-OD1 3.47Å; M276-L402 HydrophobicContact CE-CD1 3.89Å
277	E	92.3	Very high	94.6	Very high	134 Å²	134	26.9 Å²	26.9	63%	0.626	14%	0.137	S	C	*	.	H	α-helix	trans	-67.6	-47	-172.4	-166.3	-169.2	156.7	0	0	112.8	G275 K281	G275-E277 PolarHBondContact O-N 3.05Å; E277-K281 WeakPolarHBondContact O-CG 3.27Å; E277-K281 PolarHBondContact O-N 3.44Å; E277-K281 VanDerWaalsContact O-N 3.16Å; E277-K281 WeakPolarHBondContact OE1-CE 3.32Å; E277-K281 IonicContact OE1-NZ 2.66Å; E277-K281 PolarHBondContact OE1-NZ 2.95Å
278	T	95.1	Very high	94.7	Very high	26 Å²	26	27.5 Å²	27.5	16%	0.16	14%	0.14	C	C	.	.	H	α-helix	trans	-71	-40.6	178.9	-50.9	0	0	0	0	110.6	L274 L280 K281 V282 N372 M374	L274-T278 HydrophobicContact CB-CG2 4.19Å; L274-T278 HydrophobicContact CD2-CG2 4.16Å; L274-T278 VanDerWaalsContact O-CB 3.32Å; L274-T278 WeakPolarHBondContact O-CB 3.38Å; L274-T278 PolarHBondContact O-OG1 3.44Å; T278-L280 PolarHBondContact O-N 3.23Å; T278-K281 PolarHBondContact O-N 3.29Å; T278-V282 WeakPolarHBondContact O-CG2 3.4Å; T278-V282 PolarHBondContact O-N 3.45Å; T278-N372 VanDerWaalsContact CB-OD1 3.31Å; T278-N372 WeakPolarHBondContact CB-OD1 3.37Å; T278-N372 PolarHBondContact OG1-OD1 3.1Å; T278-M374 HydrophobicContact CG2-CB 4.33Å
279	C	95.9	Very high	95	Very high	1 Å²	1	28.6 Å²	28.6	1%	0.007	15%	0.145	C	C	.	.	H	α-helix	trans	-59.9	-45.5	176.9	-173.5	0	0	0	0	111.8	L271 L274 G275 K281 V282 L283	L271-C279 HydrophobicContact CD2-CB 3.85Å; L271-C279 VanDerWaalsContact CD2-SG 3.57Å; L274-C279 HydrophobicContact CB-CB 4.15Å; G275-C279 WeakPolarHBondContact O-CB 3.14Å; G275-C279 PolarHBondContact O-N 3.23Å; C279-K281 PolarHBondContact O-N 3.25Å; C279-V282 PolarHBondContact O-N 3.32Å; C279-L283 WeakPolarHBondContact O-CB 3.45Å; C279-L283 PolarHBondContact O-N 3.16Å
280	L	95.4	Very high	95.1	Very high	12 Å²	12	30.2 Å²	30.2	6%	0.063	15%	0.152	C	C	.	.	H	α-helix	trans	-65.8	-34	176.9	-72	176.9	0	0	0	112.8	M276 T278 L283 T284 L394 C395 L398	M276-L280 HydrophobicContact CG-CD1 4Å; M276-L280 WeakPolarHBondContact O-CB 3.46Å; M276-L280 VanDerWaalsContact O-CG 3.32Å; M276-L280 WeakPolarHBondContact O-CG 3.3Å; M276-L280 PolarHBondContact O-N 2.73Å; M276-L280 HydrophobicContact SD-CD1 4.14Å; M276-L280 HydrophobicContact SD-CG 4.34Å; T278-L280 PolarHBondContact O-N 3.23Å; L280-L283 HydrophobicContact CD2-CD2 4.21Å; L280-T284 VanDerWaalsContact O-CB 3.31Å; L280-T284 WeakPolarHBondContact O-CB 3.19Å; L280-T284 PolarHBondContact O-N 3.41Å; L280-T284 PolarHBondContact O-OG1 2.86Å; L280-L394 HydrophobicContact CD2-CD2 3.74Å; L280-L394 HydrophobicContact CD2-CG 4.36Å; L280-C395 WeakPolarHBondContact CD1-SG 3.18Å; L280-L398 HydrophobicContact CD2-CD1 4.14Å
281	K	95.6	Very high	95.1	Very high	81 Å²	81	31.4 Å²	31.4	35%	0.352	16%	0.157	S	C	.	.	H	α-helix	trans	-64.3	-43.3	172.5	-74.1	169.8	-173.1	168.2	0	112.2	E277 T278 C279 T284 A285 M374	E277-K281 WeakPolarHBondContact O-CG 3.27Å; E277-K281 PolarHBondContact O-N 3.44Å; E277-K281 VanDerWaalsContact O-N 3.16Å; E277-K281 WeakPolarHBondContact OE1-CE 3.32Å; E277-K281 IonicContact OE1-NZ 2.66Å; E277-K281 PolarHBondContact OE1-NZ 2.95Å; T278-K281 PolarHBondContact O-N 3.29Å; C279-K281 PolarHBondContact O-N 3.25Å; K281-T284 PolarHBondContact O-N 3.31Å; K281-A285 PolarHBondContact O-N 3.32Å; K281-M374 HydrophobicContact CB-SD 4.17Å
282	V	97.1	Very high	95.4	Very high	0 Å²	0	31 Å²	31	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-64.8	-46.9	176.2	175.1	0	0	0	0	110.6	L274 T278 C279 T284 A285 I286 V292 F309 V367 M374	L274-V282 HydrophobicContact CD1-CG2 4.2Å; T278-V282 WeakPolarHBondContact O-CG2 3.4Å; T278-V282 PolarHBondContact O-N 3.45Å; C279-V282 PolarHBondContact O-N 3.32Å; V282-T284 VanDerWaalsContact C-N 3.3Å; V282-T284 PolarHBondContact O-N 3.05Å; V282-A285 WeakPolarHBondContact O-CB 3.49Å; V282-A285 PolarHBondContact O-N 3.12Å; V282-A285 VanDerWaalsContact O-N 3.11Å; V282-I286 HydrophobicContact CG1-CD1 3.95Å; V282-I286 WeakPolarHBondContact O-CG1 3.45Å; V282-I286 PolarHBondContact O-N 3.07Å; V282-V292 HydrophobicContact CG1-CG1 4.39Å; V282-F309 HydrophobicContact CB-CE1 4.09Å; V282-F309 HydrophobicContact CB-CZ 3.9Å; V282-F309 HydrophobicContact CG1-CD1 4.34Å; V282-F309 HydrophobicContact CG1-CD2 4.41Å; V282-F309 HydrophobicContact CG1-CE1 3.79Å; V282-F309 HydrophobicContact CG1-CE2 3.88Å; V282-F309 HydrophobicContact CG1-CZ 3.53Å; V282-V367 HydrophobicContact CG1-CG2 4.18Å; V282-V367 HydrophobicContact CG2-CB 4.43Å; V282-V367 HydrophobicContact CG2-CG1 3.91Å; V282-V367 HydrophobicContact CG2-CG2 3.58Å; V282-M374 HydrophobicContact CG2-CE 4.26Å; V282-M374 HydrophobicContact CG2-CG 4.43Å; V282-M374 HydrophobicContact CG2-SD 3.81Å
283	L	96.3	Very high	95.7	Very high	5 Å²	5	24.5 Å²	24.5	3%	0.026	13%	0.125	C	C	.	.	H	α-helix	trans	-57.6	-43.3	175.3	-171	66.3	0	0	0	111.3	C279 L280 A285 I286 M287 F309 M312 L313 M440	C279-L283 WeakPolarHBondContact O-CB 3.45Å; C279-L283 PolarHBondContact O-N 3.16Å; L280-L283 HydrophobicContact CD2-CD2 4.21Å; L283-A285 PolarHBondContact O-N 3.46Å; L283-I286 PolarHBondContact O-N 2.89Å; L283-M287 HydrophobicContact CG-SD 4.22Å; L283-M287 WeakPolarHBondContact O-CB 3.35Å; L283-M287 WeakPolarHBondContact O-CG 3.45Å; L283-M287 PolarHBondContact O-N 3.34Å; L283-F309 HydrophobicContact CB-CE1 4.34Å; L283-F309 HydrophobicContact CD1-CD1 4.14Å; L283-M312 HydrophobicContact CD1-CB 4.19Å; L283-L313 HydrophobicContact CD1-CD2 3.85Å; L283-M440 HydrophobicContact CD2-CE 3.74Å; L283-M440 HydrophobicContact CD2-SD 3.87Å
284	T	96.8	Very high	95.9	Very high	6 Å²	6	22 Å²	22	4%	0.037	11%	0.112	C	C	.	.	H	α-helix	trans	-61.1	-41.2	175.4	-56.1	0	0	0	0	111.9	L280 K281 V282 M287 L288 I383 L386 F485	L280-T284 VanDerWaalsContact O-CB 3.31Å; L280-T284 WeakPolarHBondContact O-CB 3.19Å; L280-T284 PolarHBondContact O-N 3.41Å; L280-T284 PolarHBondContact O-OG1 2.86Å; K281-T284 PolarHBondContact O-N 3.31Å; V282-T284 VanDerWaalsContact C-N 3.3Å; V282-T284 PolarHBondContact O-N 3.05Å; T284-M287 PolarHBondContact O-N 2.96Å; T284-L288 HydrophobicContact CG2-CD1 3.99Å; T284-L288 HydrophobicContact CG2-CG 4.45Å; T284-L288 WeakPolarHBondContact O-CB 3.47Å; T284-L288 VanDerWaalsContact O-CG 3.25Å; T284-L288 WeakPolarHBondContact O-CG 3.39Å; T284-L288 PolarHBondContact O-N 3.24Å; T284-I383 HydrophobicContact CG2-CG2 3.54Å; T284-L386 HydrophobicContact CG2-CD2 3.99Å; T284-L386 WeakPolarHBondContact OG1-CD2 3.32Å; T284-F485 HydrophobicContact CG2-CD2 3.82Å; T284-F485 HydrophobicContact CG2-CE2 3.91Å
285	A	96.7	Very high	96	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-64.7	-41.7	176.3	0	0	0	0	0	112.3	K281 V282 L283 L288 E289 Q290 V292 M374 I383	K281-A285 PolarHBondContact O-N 3.32Å; V282-A285 WeakPolarHBondContact O-CB 3.49Å; V282-A285 PolarHBondContact O-N 3.12Å; V282-A285 VanDerWaalsContact O-N 3.11Å; L283-A285 PolarHBondContact O-N 3.46Å; A285-L288 CarbonylContact O-C 3.57Å; A285-L288 PolarHBondContact O-N 3.27Å; A285-E289 PolarHBondContact O-N 3.47Å; A285-Q290 HydrophobicContact CB-CB 4.16Å; A285-Q290 HydrophobicContact CB-CG 4.28Å; A285-Q290 VanDerWaalsContact O-CB 3.28Å; A285-Q290 WeakPolarHBondContact O-CB 3.41Å; A285-Q290 WeakPolarHBondContact O-CG 3.45Å; A285-Q290 PolarHBondContact O-N 2.77Å; A285-V292 HydrophobicContact CB-CG2 4.12Å; A285-M374 HydrophobicContact CB-CE 3.74Å; A285-I383 HydrophobicContact CB-CD1 3.83Å; A285-I383 HydrophobicContact CB-CG1 4.26Å
286	I	97.4	Very high	96.2	Very high	3 Å²	3	22 Å²	22	2%	0.015	11%	0.105	C	C	.	.	H	α-helix	trans	-65	-44.6	176.9	-64.1	170.3	0	0	0	110.6	V282 L283 L288 E289 V292 F309 L313 Y318 L344	V282-I286 HydrophobicContact CG1-CD1 3.95Å; V282-I286 WeakPolarHBondContact O-CG1 3.45Å; V282-I286 PolarHBondContact O-N 3.07Å; L283-I286 PolarHBondContact O-N 2.89Å; I286-L288 VanDerWaalsContact C-N 3.25Å; I286-L288 PolarHBondContact O-N 3.32Å; I286-E289 PolarHBondContact O-N 2.92Å; I286-E289 VanDerWaalsContact O-N 3.11Å; I286-V292 HydrophobicContact CG1-CB 4.46Å; I286-V292 HydrophobicContact CG1-CG2 4.06Å; I286-F309 HydrophobicContact CD1-CB 3.74Å; I286-F309 HydrophobicContact CD1-CD1 3.9Å; I286-F309 HydrophobicContact CD1-CD2 4.43Å; I286-F309 HydrophobicContact CD1-CG 3.78Å; I286-L313 HydrophobicContact CG2-CD1 3.95Å; I286-L313 HydrophobicContact CG2-CD2 4.34Å; I286-Y318 HydrophobicContact CG2-CD2 3.89Å; I286-Y318 HydrophobicContact CG2-CE2 3.69Å; I286-L344 HydrophobicContact CD1-CD1 3.64Å; I286-L344 HydrophobicContact CD1-CD2 4.09Å; I286-L344 HydrophobicContact CG1-CD1 4.01Å
287	M	96.5	Very high	96.3	Very high	6 Å²	6	29.5 Å²	29.5	3%	0.03	13%	0.132	C	C	.	.	H	α-helix	trans	-62.6	-29.3	175.8	-74.5	178.6	57.8	0	0	113.8	L283 T284 E289 L313 F443 F444 F485 L489	L283-M287 HydrophobicContact CG-SD 4.22Å; L283-M287 WeakPolarHBondContact O-CB 3.35Å; L283-M287 WeakPolarHBondContact O-CG 3.45Å; L283-M287 PolarHBondContact O-N 3.34Å; T284-M287 PolarHBondContact O-N 2.96Å; M287-E289 VanDerWaalsContact C-N 3.29Å; M287-L313 HydrophobicContact CG-CD2 3.41Å; M287-L313 VanDerWaalsContact CG-CD2 3.41Å; M287-F443 HydrophobicContact CE-CE1 4.17Å; M287-F444 HydrophobicContact CE-CD1 4.44Å; M287-F444 HydrophobicContact CE-CE1 3.28Å; M287-F444 HydrophobicContact CE-CZ 3.49Å; M287-F444 VanDerWaalsContact CE-CZ 3.49Å; M287-F444 HydrophobicContact SD-CE1 4.33Å; M287-F444 HydrophobicContact SD-CZ 3.94Å; M287-F485 HydrophobicContact CE-CE2 4.06Å; M287-F485 HydrophobicContact CE-CZ 3.62Å; M287-L489 HydrophobicContact CB-CD1 4.35Å; M287-L489 HydrophobicContact CE-CD1 3.93Å; M287-L489 HydrophobicContact CE-CD2 4.22Å
288	L	96.5	Very high	96.5	Very high	13 Å²	13	26.9 Å²	26.9	7%	0.068	12%	0.122	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.7	23	176.1	-63.1	-179.8	0	0	0	112.5	T284 A285 I286 Q290 P384 F485 K488 L489	T284-L288 HydrophobicContact CG2-CD1 3.99Å; T284-L288 HydrophobicContact CG2-CG 4.45Å; T284-L288 WeakPolarHBondContact O-CB 3.47Å; T284-L288 VanDerWaalsContact O-CG 3.25Å; T284-L288 WeakPolarHBondContact O-CG 3.39Å; T284-L288 PolarHBondContact O-N 3.24Å; A285-L288 CarbonylContact O-C 3.57Å; A285-L288 PolarHBondContact O-N 3.27Å; I286-L288 VanDerWaalsContact C-N 3.25Å; I286-L288 PolarHBondContact O-N 3.32Å; L288-Q290 HydrophobicContact CB-CG 4.46Å; L288-Q290 PolarHBondContact O-N 2.88Å; L288-Q290 VanDerWaalsContact O-N 3.12Å; L288-Q290 PolarHBondContact O-NE2 3.07Å; L288-P384 HydrophobicContact CD1-CG 3.45Å; L288-P384 VanDerWaalsContact CD1-CG 3.45Å; L288-F485 HydrophobicContact CD1-CD2 4.11Å; L288-F485 HydrophobicContact CD2-CD2 4.13Å; L288-F485 HydrophobicContact CD2-CE2 4.28Å; L288-F485 HydrophobicContact CG-CD2 4.29Å; L288-F485 HydrophobicContact CG-CE2 4.42Å; L288-K488 HydrophobicContact CD2-CB 3.74Å; L288-L489 HydrophobicContact CD2-CB 4.04Å; L288-L489 HydrophobicContact CD2-CD1 4.43Å
289	E	95.9	Very high	96.5	Very high	36 Å²	36	27.4 Å²	27.4	17%	0.168	12%	0.121	C	C	.	.	T	Hydrogen-bonded Turn	trans	54.1	37.4	171.3	-55.1	-174.3	154.6	0	0	112.8	A285 I286 M287 F320 P342 T492 Q493 A494	A285-E289 PolarHBondContact O-N 3.47Å; I286-E289 PolarHBondContact O-N 2.92Å; I286-E289 VanDerWaalsContact O-N 3.11Å; M287-E289 VanDerWaalsContact C-N 3.29Å; E289-F320 HydrophobicContact CB-CE2 4.04Å; E289-F320 HydrophobicContact CB-CZ 4.48Å; E289-F320 VanDerWaalsContact CD-CE2 3.41Å; E289-F320 HydrophobicContact CG-CE2 3.68Å; E289-F320 HydrophobicContact CG-CZ 4.32Å; E289-F320 WeakPolarHBondContact OE1-CE2 3.26Å; E289-P342 HydrophobicContact CB-CB 4.32Å; E289-P342 HydrophobicContact CB-CG 3.94Å; E289-P342 VanDerWaalsContact O-CB 3.3Å; E289-P342 WeakPolarHBondContact O-CB 3.3Å; E289-P342 WeakPolarHBondContact O-CG 3.39Å; E289-T492 HydrophobicContact CG-CG2 3.79Å; E289-T492 WeakPolarHBondContact OE1-CB 3.29Å; E289-T492 WeakPolarHBondContact OE2-CA 3.4Å; E289-Q493 VanDerWaalsContact CD-N 3.31Å; E289-Q493 WeakPolarHBondContact OE1-CA 3.26Å; E289-Q493 WeakPolarHBondContact OE1-CB 3.4Å; E289-Q493 PolarHBondContact OE1-N 2.64Å; E289-Q493 PolarHBondContact OE2-N 3.01Å; E289-Q493 VanDerWaalsContact OE2-N 3.07Å; E289-A494 PolarHBondContact OE1-N 3.21Å
290	Q	95.2	Very high	96.5	Very high	57 Å²	57	29.1 Å²	29.1	27%	0.266	13%	0.13	S	C	.	.			trans	-82.4	156.2	173.5	-56.6	-59.8	-67.6	0	0	111.1	A285 L288	A285-Q290 HydrophobicContact CB-CB 4.16Å; A285-Q290 HydrophobicContact CB-CG 4.28Å; A285-Q290 VanDerWaalsContact O-CB 3.28Å; A285-Q290 WeakPolarHBondContact O-CB 3.41Å; A285-Q290 WeakPolarHBondContact O-CG 3.45Å; A285-Q290 PolarHBondContact O-N 2.77Å; L288-Q290 HydrophobicContact CB-CG 4.46Å; L288-Q290 PolarHBondContact O-N 2.88Å; L288-Q290 VanDerWaalsContact O-N 3.12Å; L288-Q290 PolarHBondContact O-NE2 3.07Å
291	K	96.8	Very high	96.5	Very high	25 Å²	25	29 Å²	29	11%	0.109	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	120.9	171.8	-61	173.3	-172.7	-177.7	0	109.5	S339 P340 T341 F343 D363 V364 W365	K291-S339 VanDerWaalsContact CE-O 3.27Å; K291-S339 WeakPolarHBondContact CE-O 3.42Å; K291-S339 PolarHBondContact NZ-O 2.91Å; K291-P340 WeakPolarHBondContact CE-O 3.43Å; K291-P340 PolarHBondContact NZ-O 3.28Å; K291-T341 VanDerWaalsContact CE-O 3.29Å; K291-T341 WeakPolarHBondContact CE-O 3.36Å; K291-F343 HydrophobicContact CB-CD1 4.39Å; K291-F343 HydrophobicContact CB-CE1 4.03Å; K291-F343 HydrophobicContact CB-CE2 4.14Å; K291-F343 HydrophobicContact CB-CZ 3.9Å; K291-F343 HydrophobicContact CD-CD1 4.33Å; K291-F343 HydrophobicContact CD-CE1 3.71Å; K291-F343 HydrophobicContact CD-CZ 4.18Å; K291-F343 HydrophobicContact CG-CD1 4.03Å; K291-F343 HydrophobicContact CG-CE1 3.81Å; K291-F343 HydrophobicContact CG-CZ 4.2Å; K291-D363 WeakPolarHBondContact CE-OD2 3.31Å; K291-D363 IonicContact NZ-OD2 3.22Å; K291-D363 PolarHBondContact NZ-OD2 3.44Å; K291-V364 HydrophobicContact CB-CB 4.3Å; K291-V364 HydrophobicContact CB-CG1 4.24Å; K291-V364 HydrophobicContact CB-CG2 3.85Å; K291-V364 HydrophobicContact CD-CG2 3.94Å; K291-W365 PolarHBondContact O-N 3.36Å
292	V	97.8	Very high	96.6	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	128.6	-176.2	-177.6	0	0	0	0	110.4	V282 A285 I286 L294 F343 L344 I345 W365 V367	V282-V292 HydrophobicContact CG1-CG1 4.39Å; A285-V292 HydrophobicContact CB-CG2 4.12Å; I286-V292 HydrophobicContact CG1-CB 4.46Å; I286-V292 HydrophobicContact CG1-CG2 4.06Å; V292-L294 HydrophobicContact CG1-CD1 4Å; V292-F343 PolarHBondContact N-O 3.06Å; V292-L344 HydrophobicContact CB-CD1 3.82Å; V292-L344 HydrophobicContact CG1-CD1 3.88Å; V292-L344 WeakPolarHBondContact O-CA 3.27Å; V292-I345 PolarHBondContact O-N 2.65Å; V292-W365 HydrophobicContact CG2-CB 4.48Å; V292-V367 HydrophobicContact CG1-CG2 3.9Å
293	V	98.2	Very high	96.7	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	128	172.2	174.7	0	0	0	0	108.7	L337 F343 I345 I347 F360 V364 W365 L366 V367	V293-L337 HydrophobicContact CG2-CD2 3.85Å; V293-F343 HydrophobicContact CG2-CE2 3.86Å; V293-I345 CarbonylContact C-O 3.52Å; V293-I345 VanDerWaalsContact CA-O 3.24Å; V293-I345 WeakPolarHBondContact CA-O 3.48Å; V293-I347 HydrophobicContact CG1-CD1 3.52Å; V293-I347 HydrophobicContact CG1-CG1 3.63Å; V293-I347 HydrophobicContact CG1-CG2 4.35Å; V293-F360 HydrophobicContact CB-CE2 4.44Å; V293-F360 HydrophobicContact CB-CZ 4.36Å; V293-F360 HydrophobicContact CG2-CE2 4.19Å; V293-F360 HydrophobicContact CG2-CZ 4.25Å; V293-V364 HydrophobicContact CB-CG1 4.31Å; V293-V364 HydrophobicContact CG2-CG1 3.58Å; V293-W365 PolarHBondContact N-O 3.11Å; V293-L366 HydrophobicContact CB-CD1 4.11Å; V293-L366 HydrophobicContact CG1-CD1 3.75Å; V293-L366 CarbonylContact O-C 3.13Å; V293-V367 PolarHBondContact O-N 3.06Å
294	L	98.3	Very high	96.7	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	141.6	170.2	-71.3	89.3	0	0	0	109.5	V292 L302 V306 F309 L344 I345 G346 I347 V367 L369	V292-L294 HydrophobicContact CG1-CD1 4Å; L294-L302 HydrophobicContact CB-CD1 3.72Å; L294-L302 WeakPolarHBondContact O-CD1 3.38Å; L294-V306 HydrophobicContact CB-CG2 4.48Å; L294-V306 HydrophobicContact CD1-CG2 4.18Å; L294-F309 HydrophobicContact CD2-CD2 3.95Å; L294-F309 HydrophobicContact CD2-CE2 3.83Å; L294-L344 HydrophobicContact CD1-CD1 3.39Å; L294-L344 HydrophobicContact CD1-CG 4.26Å; L294-I345 PolarHBondContact N-O 3.4Å; L294-G346 CarbonylContact O-C 3.56Å; L294-G346 WeakPolarHBondContact O-CA 3.49Å; L294-I347 WeakPolarHBondContact O-CG1 3.16Å; L294-I347 PolarHBondContact O-N 3.42Å; L294-V367 CarbonylContact C-O 3.32Å; L294-V367 WeakPolarHBondContact CA-O 3.49Å; L294-V367 HydrophobicContact CG-CB 4.19Å; L294-V367 HydrophobicContact CG-CG1 4.47Å; L294-L369 HydrophobicContact CD2-CD1 4.12Å; L294-L369 HydrophobicContact CD2-CD2 4.06Å; L294-L369 HydrophobicContact CD2-CG 4.23Å
295	Q	97.2	Very high	96.7	Very high	24 Å²	24	25 Å²	25	11%	0.112	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	145.4	170.8	72.6	175.9	25.1	0	0	112.2	I347 L366 V367 D368 L369	Q295-I347 WeakPolarHBondContact CA-O 3.41Å; Q295-I347 HydrophobicContact CB-CG1 3.98Å; Q295-L366 HydrophobicContact CB-CD1 4.38Å; Q295-L366 HydrophobicContact CG-CD1 4.15Å; Q295-V367 PolarHBondContact N-O 3.12Å; Q295-D368 HydrophobicContact CG-CB 4.05Å; Q295-D368 PolarHBondContact NE2-OD2 3.4Å; Q295-L369 PolarHBondContact O-N 3.03Å
296	S	97.1	Very high	96.8	Very high	2 Å²	2	25 Å²	25	1%	0.014	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.1	160.3	171.5	-178.5	0	0	0	0	110.3	D298 A349 D370	S296-D298 PolarHBondContact OG-N 2.95Å; S296-D298 PolarHBondContact OG-O 3.09Å; S296-A349 PolarHBondContact O-N 3.2Å; S296-D370 WeakPolarHBondContact CA-OD1 3.49Å; S296-D370 VanDerWaalsContact CB-OD1 3.29Å; S296-D370 WeakPolarHBondContact CB-OD1 3.45Å; S296-D370 PolarHBondContact OG-OD1 2.96Å
297	R	94.7	Very high	96.7	Very high	188 Å²	188	25.6 Å²	25.6	71%	0.709	12%	0.116	S	C	*	.	S	Bend	trans	-80.7	-19.1	164.8	-70.4	168.3	-68.7	163.2	7.4	113	A349 D370	R297-A349 HydrophobicContact CG-CB 3.8Å; R297-D370 WeakPolarHBondContact CB-OD2 3.29Å; R297-D370 WeakPolarHBondContact CG-OD2 3.39Å; R297-D370 IonicContact CZ-OD2 2.88Å; R297-D370 VanDerWaalsContact CZ-OD2 3.3Å; R297-D370 PolarHBondContact N-OD2 2.85Å; R297-D370 VanDerWaalsContact N-OD2 3.07Å; R297-D370 IonicContact NE-OD2 2.76Å; R297-D370 PolarHBondContact NE-OD2 3.33Å; R297-D370 IonicContact NH2-OD2 3.3Å; R297-D370 PolarHBondContact NH2-OD2 2.88Å
298	D	95.5	Very high	96.7	Very high	79 Å²	79	25.3 Å²	25.3	42%	0.422	12%	0.115	S	C	.	.			trans	-98.8	111	174.5	178.7	12	0	0	0	110.7	S296 N300 A301 L302	S296-D298 PolarHBondContact OG-N 2.95Å; S296-D298 PolarHBondContact OG-O 3.09Å; D298-N300 PolarHBondContact O-N 2.93Å; D298-N300 VanDerWaalsContact OD1-CB 3.29Å; D298-N300 WeakPolarHBondContact OD1-CB 2.77Å; D298-N300 PolarHBondContact OD1-N 3.02Å; D298-A301 HydrophobicContact CB-CB 3.9Å; D298-A301 PolarHBondContact O-N 3.4Å; D298-A301 WeakPolarHBondContact OD2-CB 3.48Å; D298-A301 PolarHBondContact OD2-N 3.03Å; D298-L302 VanDerWaalsContact O-CB 3.31Å; D298-L302 WeakPolarHBondContact O-CB 3.19Å; D298-L302 PolarHBondContact O-N 2.7Å
299	Y	95.2	Very high	96.8	Very high	37 Å²	37	24.7 Å²	24.7	15%	0.145	11%	0.112	C	C	.	.	H	α-helix	trans	-63.8	-28	177.6	-47.5	-32.6	0	0	0	112.4	P63 E64 F81 T303 L325 P348	P63-Y299 HydrophobicContact CG-CD2 3.79Å; P63-Y299 HydrophobicContact CG-CE1 4.37Å; P63-Y299 HydrophobicContact CG-CE2 3.39Å; P63-Y299 HydrophobicContact CG-CG 4.43Å; E64-Y299 WeakPolarHBondContact CG-OH 3.41Å; E64-Y299 PolarHBondContact OE1-OH 3.4Å; F81-Y299 HydrophobicContact CD1-CD2 4.05Å; F81-Y299 HydrophobicContact CE1-CD2 4.01Å; F81-Y299 HydrophobicContact CZ-CD2 4.42Å; Y299-T303 VanDerWaalsContact O-CB 3.28Å; Y299-T303 WeakPolarHBondContact O-CB 3.39Å; Y299-T303 WeakPolarHBondContact O-CG2 3.22Å; Y299-T303 PolarHBondContact O-N 2.82Å; Y299-T303 PolarHBondContact O-OG1 3.27Å; Y299-L325 HydrophobicContact CD1-CD1 4.41Å; Y299-P348 HydrophobicContact CD1-CG 4.45Å; Y299-P348 HydrophobicContact CE1-CB 3.96Å; Y299-P348 HydrophobicContact CE1-CG 4.01Å
300	N	96	Very high	96.8	Very high	37 Å²	37	24.9 Å²	24.9	20%	0.198	12%	0.115	C	C	.	.	H	α-helix	trans	-69.5	-53.3	175.4	-171.9	63.5	0	0	0	110.2	T80 F81 R161 D298 L302 T303 M304	T80-N300 VanDerWaalsContact O-CB 3.27Å; T80-N300 WeakPolarHBondContact O-CB 3.32Å; T80-N300 PolarHBondContact O-OD1 2.93Å; F81-N300 HydrophobicContact CB-CB 4.28Å; R161-N300 PolarHBondContact NH1-OD1 3.36Å; R161-N300 PolarHBondContact NH2-OD1 3.06Å; D298-N300 PolarHBondContact O-N 2.93Å; D298-N300 VanDerWaalsContact OD1-CB 3.29Å; D298-N300 WeakPolarHBondContact OD1-CB 2.77Å; D298-N300 PolarHBondContact OD1-N 3.02Å; N300-L302 VanDerWaalsContact C-N 3.28Å; N300-L302 PolarHBondContact O-N 3.26Å; N300-T303 PolarHBondContact O-N 3.04Å; N300-T303 PolarHBondContact O-OG1 3.5Å; N300-M304 WeakPolarHBondContact O-CB 3.38Å; N300-M304 WeakPolarHBondContact O-CG 3.29Å; N300-M304 PolarHBondContact O-N 3.42Å
301	A	96.8	Very high	96.8	Very high	11 Å²	11	23.2 Å²	23.2	9%	0.091	11%	0.111	C	C	.	.	H	α-helix	trans	-55.1	-44.7	176	0	0	0	0	0	112.1	L273 D298 S305	L273-A301 HydrophobicContact CD1-CB 4.03Å; D298-A301 HydrophobicContact CB-CB 3.9Å; D298-A301 PolarHBondContact O-N 3.4Å; D298-A301 WeakPolarHBondContact OD2-CB 3.48Å; D298-A301 PolarHBondContact OD2-N 3.03Å; A301-S305 WeakPolarHBondContact O-CB 3.16Å; A301-S305 PolarHBondContact O-N 3.38Å; A301-S305 PolarHBondContact O-OG 2.89Å
302	L	97.8	Very high	96.7	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-58.8	-55.6	176.8	-176.9	62.2	0	0	0	113	L294 D298 N300 S305 V306 L325 I347 L369	L294-L302 HydrophobicContact CB-CD1 3.72Å; L294-L302 WeakPolarHBondContact O-CD1 3.38Å; D298-L302 VanDerWaalsContact O-CB 3.31Å; D298-L302 WeakPolarHBondContact O-CB 3.19Å; D298-L302 PolarHBondContact O-N 2.7Å; N300-L302 VanDerWaalsContact C-N 3.28Å; N300-L302 PolarHBondContact O-N 3.26Å; L302-S305 PolarHBondContact O-N 2.88Å; L302-V306 WeakPolarHBondContact O-CG2 3.47Å; L302-V306 PolarHBondContact O-N 3.45Å; L302-L325 HydrophobicContact CD2-CD1 3.96Å; L302-I347 VanDerWaalsContact CD2-O 3.25Å; L302-I347 WeakPolarHBondContact CD2-O 3.23Å; L302-L369 HydrophobicContact CD1-CD1 4.13Å
303	T	97.3	Very high	96.6	Very high	0 Å²	0	22.4 Å²	22.4	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-67.7	-43.9	-173	51.4	0	0	0	0	111.6	V82 Y299 N300 S305 V306 M307 P324 L325	V82-T303 WeakPolarHBondContact O-CB 3.21Å; V82-T303 WeakPolarHBondContact O-CG2 3.26Å; V82-T303 PolarHBondContact O-OG1 3.02Å; Y299-T303 VanDerWaalsContact O-CB 3.28Å; Y299-T303 WeakPolarHBondContact O-CB 3.39Å; Y299-T303 WeakPolarHBondContact O-CG2 3.22Å; Y299-T303 PolarHBondContact O-N 2.82Å; Y299-T303 PolarHBondContact O-OG1 3.27Å; N300-T303 PolarHBondContact O-N 3.04Å; N300-T303 PolarHBondContact O-OG1 3.5Å; T303-S305 VanDerWaalsContact C-N 3.31Å; T303-S305 PolarHBondContact O-N 3.32Å; T303-V306 PolarHBondContact O-N 3.46Å; T303-M307 WeakPolarHBondContact O-CE 3.15Å; T303-M307 WeakPolarHBondContact O-CG 3.01Å; T303-M307 PolarHBondContact O-N 3.04Å; T303-P324 HydrophobicContact CG2-CB 3.97Å; T303-P324 WeakPolarHBondContact CG2-O 3.36Å; T303-L325 HydrophobicContact CG2-CB 3.62Å
304	M	96.2	Very high	96.4	Very high	7 Å²	7	23.5 Å²	23.5	3%	0.034	11%	0.112	C	C	.	.	H	α-helix	trans	-63.8	-36.9	174.4	-60.4	-53.9	-179.8	0	0	111.4	V82 F157 R161 F265 L269 N300 M307 A308	V82-M304 HydrophobicContact CB-CE 4.16Å; V82-M304 HydrophobicContact CG2-CE 3.55Å; F157-M304 HydrophobicContact CD2-CE 4.39Å; F157-M304 HydrophobicContact CD2-SD 4.43Å; R161-M304 VanDerWaalsContact NH2-CE 3.31Å; F265-M304 HydrophobicContact CB-CG 4.41Å; F265-M304 HydrophobicContact CB-SD 3.38Å; F265-M304 WeakPolarHBondContact CB-SD 3.33Å; F265-M304 HydrophobicContact CG-SD 4.24Å; L269-M304 HydrophobicContact CD2-CB 3.77Å; N300-M304 WeakPolarHBondContact O-CB 3.38Å; N300-M304 WeakPolarHBondContact O-CG 3.29Å; N300-M304 PolarHBondContact O-N 3.42Å; M304-M307 PolarHBondContact O-N 2.86Å; M304-M307 HydrophobicContact SD-CE 3.44Å; M304-M307 WeakPolarHBondContact SD-CE 3.44Å; M304-A308 WeakPolarHBondContact O-CB 3.46Å; M304-A308 PolarHBondContact O-N 3.47Å
305	S	97.8	Very high	96.3	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-66.6	-42.9	177.4	-64.6	0	0	0	0	113.2	A301 L302 T303 M307 A308 F309	A301-S305 WeakPolarHBondContact O-CB 3.16Å; A301-S305 PolarHBondContact O-N 3.38Å; A301-S305 PolarHBondContact O-OG 2.89Å; L302-S305 PolarHBondContact O-N 2.88Å; T303-S305 VanDerWaalsContact C-N 3.31Å; T303-S305 PolarHBondContact O-N 3.32Å; S305-M307 VanDerWaalsContact C-N 3.35Å; S305-M307 PolarHBondContact O-N 2.97Å; S305-A308 PolarHBondContact O-N 3.23Å; S305-F309 WeakPolarHBondContact O-CD2 3.38Å; S305-F309 PolarHBondContact O-N 3.11Å
306	V	97.9	Very high	96.1	Very high	1 Å²	1	23 Å²	23	1%	0.006	11%	0.111	C	C	.	.	H	α-helix	trans	-59.1	-47.7	175.2	171.9	0	0	0	0	110.5	L294 L302 T303 F309 T310 P324 L344	L294-V306 HydrophobicContact CB-CG2 4.48Å; L294-V306 HydrophobicContact CD1-CG2 4.18Å; L302-V306 WeakPolarHBondContact O-CG2 3.47Å; L302-V306 PolarHBondContact O-N 3.45Å; T303-V306 PolarHBondContact O-N 3.46Å; V306-F309 PolarHBondContact O-N 3.21Å; V306-T310 PolarHBondContact O-N 3.32Å; V306-P324 HydrophobicContact CB-CB 4.36Å; V306-P324 HydrophobicContact CG1-CB 4.39Å; V306-P324 HydrophobicContact CG1-CG 4.33Å; V306-L344 HydrophobicContact CG1-CD2 4Å; V306-L344 HydrophobicContact CG1-CG 4.11Å
307	M	96.1	Very high	95.9	Very high	14 Å²	14	25 Å²	25	7%	0.069	12%	0.12	C	C	.	.	H	α-helix	trans	-65.2	-42.6	178.6	-65.1	-173.9	-64.8	0	0	111.6	V82 F157 F265 T303 M304 S305 F309 T310 A311 P324	V82-M307 HydrophobicContact CB-CE 4.25Å; V82-M307 HydrophobicContact CG1-CE 4.17Å; F157-M307 HydrophobicContact CD2-CE 4.19Å; F157-M307 HydrophobicContact CE2-CE 3.59Å; F157-M307 HydrophobicContact CE2-SD 3.7Å; F157-M307 HydrophobicContact CZ-CE 4.37Å; F157-M307 HydrophobicContact CZ-SD 4.01Å; F265-M307 HydrophobicContact CD1-CE 4.38Å; F265-M307 HydrophobicContact CD2-CB 4.23Å; F265-M307 HydrophobicContact CE1-CB 4.07Å; F265-M307 HydrophobicContact CE2-CB 3.77Å; F265-M307 HydrophobicContact CZ-CB 3.66Å; T303-M307 WeakPolarHBondContact O-CE 3.15Å; T303-M307 WeakPolarHBondContact O-CG 3.01Å; T303-M307 PolarHBondContact O-N 3.04Å; M304-M307 PolarHBondContact O-N 2.86Å; M304-M307 HydrophobicContact SD-CE 3.44Å; M304-M307 WeakPolarHBondContact SD-CE 3.44Å; S305-M307 VanDerWaalsContact C-N 3.35Å; S305-M307 PolarHBondContact O-N 2.97Å; M307-F309 PolarHBondContact O-N 3.23Å; M307-T310 PolarHBondContact O-N 3.26Å; M307-T310 PolarHBondContact O-OG1 3.13Å; M307-A311 WeakPolarHBondContact O-CB 3.19Å; M307-A311 PolarHBondContact O-N 3.13Å; M307-P324 HydrophobicContact CG-CB 4.36Å; M307-P324 HydrophobicContact CG-CG 3.89Å; M307-P324 HydrophobicContact SD-CG 4.32Å
308	A	97	Very high	95.7	Very high	0 Å²	0	16.9 Å²	16.9	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-60.3	-43.3	176.2	0	0	0	0	0	112.8	F265 L267 P270 M304 S305 T310 A311 M312	F265-A308 HydrophobicContact CD2-CB 4.39Å; F265-A308 HydrophobicContact CE2-CB 4.32Å; L267-A308 HydrophobicContact CD1-CB 4.15Å; L267-A308 WeakPolarHBondContact CD1-O 3.41Å; P270-A308 HydrophobicContact CG-CB 3.69Å; M304-A308 WeakPolarHBondContact O-CB 3.46Å; M304-A308 PolarHBondContact O-N 3.47Å; S305-A308 PolarHBondContact O-N 3.23Å; A308-T310 PolarHBondContact O-N 2.88Å; A308-A311 PolarHBondContact O-N 2.97Å; A308-M312 HydrophobicContact CB-CE 4.21Å; A308-M312 WeakPolarHBondContact O-CB 3.34Å; A308-M312 WeakPolarHBondContact O-CG 3.11Å; A308-M312 PolarHBondContact O-N 3.46Å
309	F	97.7	Very high	95.3	Very high	0 Å²	0	15.9 Å²	15.9	0%	0	8%	0.083	C	C	.	.	H	α-helix	trans	-59.9	-45	173.8	-85.5	-60.6	0	0	0	112.5	P270 L274 V282 L283 I286 L294 S305 V306 M307 A311 M312 L344	P270-F309 HydrophobicContact CB-CD2 4.25Å; P270-F309 HydrophobicContact CB-CE1 4.16Å; P270-F309 HydrophobicContact CB-CE2 3.61Å; P270-F309 HydrophobicContact CB-CZ 3.56Å; P270-F309 HydrophobicContact CG-CD2 4.18Å; P270-F309 HydrophobicContact CG-CE2 4.02Å; P270-F309 HydrophobicContact CG-CZ 4.34Å; L274-F309 HydrophobicContact CD1-CE2 4.24Å; L274-F309 HydrophobicContact CD1-CZ 3.91Å; V282-F309 HydrophobicContact CB-CE1 4.09Å; V282-F309 HydrophobicContact CB-CZ 3.9Å; V282-F309 HydrophobicContact CG1-CD1 4.34Å; V282-F309 HydrophobicContact CG1-CD2 4.41Å; V282-F309 HydrophobicContact CG1-CE1 3.79Å; V282-F309 HydrophobicContact CG1-CE2 3.88Å; V282-F309 HydrophobicContact CG1-CZ 3.53Å; L283-F309 HydrophobicContact CB-CE1 4.34Å; L283-F309 HydrophobicContact CD1-CD1 4.14Å; I286-F309 HydrophobicContact CD1-CB 3.74Å; I286-F309 HydrophobicContact CD1-CD1 3.9Å; I286-F309 HydrophobicContact CD1-CD2 4.43Å; I286-F309 HydrophobicContact CD1-CG 3.78Å; L294-F309 HydrophobicContact CD2-CD2 3.95Å; L294-F309 HydrophobicContact CD2-CE2 3.83Å; S305-F309 WeakPolarHBondContact O-CD2 3.38Å; S305-F309 PolarHBondContact O-N 3.11Å; V306-F309 PolarHBondContact O-N 3.21Å; M307-F309 PolarHBondContact O-N 3.23Å; F309-A311 VanDerWaalsContact C-N 3.31Å; F309-A311 PolarHBondContact O-N 3.33Å; F309-M312 HydrophobicContact CD1-CE 4.19Å; F309-M312 HydrophobicContact CE1-CE 4.46Å; F309-L344 HydrophobicContact CB-CD2 4.23Å
310	T	95.7	Very high	95.2	Very high	40 Å²	40	16.1 Å²	16.1	25%	0.245	9%	0.085	C	C	.	.	H	α-helix	trans	-64.6	-35.2	176.9	59	0	0	0	0	112.9	V306 M307 A308 Y318 A322 L344	V306-T310 PolarHBondContact O-N 3.32Å; M307-T310 PolarHBondContact O-N 3.26Å; M307-T310 PolarHBondContact O-OG1 3.13Å; A308-T310 PolarHBondContact O-N 2.88Å; T310-Y318 HydrophobicContact CG2-CD1 4.2Å; T310-Y318 HydrophobicContact CG2-CG 4.27Å; T310-A322 HydrophobicContact CG2-CB 3.93Å; T310-L344 HydrophobicContact CG2-CD2 3.68Å
311	A	95.4	Very high	95	Very high	22 Å²	22	17.7 Å²	17.7	18%	0.182	10%	0.097	C	C	.	.	H	α-helix	trans	-80.5	-27.2	-178.2	0	0	0	0	0	113.8	I263 F265 L267 M307 A308 F309 L313 Y314	I263-A311 HydrophobicContact CD1-CB 3.65Å; I263-A311 HydrophobicContact CG1-CB 4.43Å; F265-A311 HydrophobicContact CE2-CB 4.26Å; F265-A311 HydrophobicContact CZ-CB 4.21Å; L267-A311 HydrophobicContact CD1-CB 3.73Å; M307-A311 WeakPolarHBondContact O-CB 3.19Å; M307-A311 PolarHBondContact O-N 3.13Å; A308-A311 PolarHBondContact O-N 2.97Å; F309-A311 VanDerWaalsContact C-N 3.31Å; F309-A311 PolarHBondContact O-N 3.33Å; A311-L313 PolarHBondContact O-N 3.35Å; A311-Y314 PolarHBondContact O-N 3.39Å
312	M	95.1	Very high	94.9	Very high	3 Å²	3	18.8 Å²	18.8	2%	0.015	11%	0.106	C	C	.	.	H	α-helix	trans	-66.1	-18.8	172.7	-82.6	-170.9	-92.7	0	0	113.2	L267 P270 L283 A308 F309 Y314 T436 M440	L267-M312 HydrophobicContact CD1-CG 3.67Å; L267-M312 HydrophobicContact CD2-CG 4.13Å; L267-M312 HydrophobicContact CG-CG 3.72Å; L267-M312 WeakPolarHBondContact O-CE 3.47Å; P270-M312 HydrophobicContact CB-CE 4.01Å; P270-M312 HydrophobicContact CG-CE 3.67Å; L283-M312 HydrophobicContact CD1-CB 4.19Å; A308-M312 HydrophobicContact CB-CE 4.21Å; A308-M312 WeakPolarHBondContact O-CB 3.34Å; A308-M312 WeakPolarHBondContact O-CG 3.11Å; A308-M312 PolarHBondContact O-N 3.46Å; F309-M312 HydrophobicContact CD1-CE 4.19Å; F309-M312 HydrophobicContact CE1-CE 4.46Å; M312-Y314 PolarHBondContact O-N 2.84Å; M312-T436 HydrophobicContact CG-CG2 4.12Å; M312-T436 HydrophobicContact SD-CG2 4.2Å; M312-M440 VanDerWaalsContact O-CG 3.28Å; M312-M440 WeakPolarHBondContact O-CG 3.29Å
313	L	95.4	Very high	94.8	Very high	5 Å²	5	20.5 Å²	20.5	3%	0.026	12%	0.115	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-16	179	-64	173.7	0	0	0	113.8	L283 I286 M287 A311 L316 Y318 F444	L283-L313 HydrophobicContact CD1-CD2 3.85Å; I286-L313 HydrophobicContact CG2-CD1 3.95Å; I286-L313 HydrophobicContact CG2-CD2 4.34Å; M287-L313 HydrophobicContact CG-CD2 3.41Å; M287-L313 VanDerWaalsContact CG-CD2 3.41Å; A311-L313 PolarHBondContact O-N 3.35Å; L313-L316 CarbonylContact C-O 3.53Å; L313-L316 VanDerWaalsContact C-O 3.29Å; L313-L316 HydrophobicContact CB-CB 4.29Å; L313-L316 WeakPolarHBondContact CB-O 3.46Å; L313-L316 WeakPolarHBondContact O-CA 3.42Å; L313-L316 WeakPolarHBondContact O-CB 3.38Å; L313-L316 PolarHBondContact O-N 3.49Å; L313-Y318 HydrophobicContact CD1-CD2 3.89Å; L313-Y318 HydrophobicContact CD1-CG 4.33Å; L313-F444 WeakPolarHBondContact O-CE2 3.24Å
314	Y	95.4	Very high	94.7	Very high	23 Å²	23	20.8 Å²	20.8	9%	0.09	12%	0.117	C	C	.	.	T	Hydrogen-bonded Turn	trans	-47.7	123.9	-177.8	-179.6	-100.4	0	0	0	112	L260 A311 M312 R437 V441 W501 N507 F510	L260-Y314 HydrophobicContact CD2-CD1 4.17Å; L260-Y314 HydrophobicContact CD2-CE1 3.66Å; A311-Y314 PolarHBondContact O-N 3.39Å; M312-Y314 PolarHBondContact O-N 2.84Å; Y314-R437 HydrophobicContact CD1-CB 4.46Å; Y314-V441 HydrophobicContact CD1-CG2 3.51Å; Y314-V441 HydrophobicContact CE1-CG2 3.5Å; Y314-V441 VanDerWaalsContact CE1-CG2 3.5Å; Y314-W501 HydrophobicContact CE2-CH2 4.21Å; Y314-W501 HydrophobicContact CE2-CZ2 4.31Å; Y314-N507 PolarHBondContact OH-OD1 3.38Å; Y314-F510 PolarHBondContact OH-N 3.02Å; Y314-F510 VanDerWaalsContact OH-N 3.13Å
315	P	94.4	Very high	94.7	Very high	6 Å²	6	20.5 Å²	20.5	4%	0.039	12%	0.115	C	C	.	.	T	Hydrogen-bonded Turn	cis	-93	0.7	18	40	-37.5	0	0	0	115.5	F498 W501 F510	P315-F498 HydrophobicContact CB-CD2 4.24Å; P315-F498 HydrophobicContact CB-CE2 3.68Å; P315-F498 HydrophobicContact CG-CD2 4.15Å; P315-F498 HydrophobicContact CG-CE2 3.42Å; P315-F498 VanDerWaalsContact CG-CE2 3.42Å; P315-F498 HydrophobicContact CG-CZ 3.79Å; P315-W501 HydrophobicContact CB-CH2 4.3Å; P315-W501 HydrophobicContact CB-CZ3 4.03Å; P315-F510 HydrophobicContact CB-CD2 3.81Å; P315-F510 HydrophobicContact CB-CE2 4.17Å; P315-F510 HydrophobicContact CG-CD2 3.86Å; P315-F510 HydrophobicContact CG-CE2 3.74Å
316	L	94.8	Very high	94.6	Very high	7 Å²	7	20.6 Å²	20.6	4%	0.037	12%	0.116	C	C	.	.	S	Bend	trans	-69.4	141.8	169.8	-58.2	-170.8	0	0	0	109.9	L313 F444 L450 L489 A494 F498	L313-L316 CarbonylContact C-O 3.53Å; L313-L316 VanDerWaalsContact C-O 3.29Å; L313-L316 HydrophobicContact CB-CB 4.29Å; L313-L316 WeakPolarHBondContact CB-O 3.46Å; L313-L316 WeakPolarHBondContact O-CA 3.42Å; L313-L316 WeakPolarHBondContact O-CB 3.38Å; L313-L316 PolarHBondContact O-N 3.49Å; L316-F444 HydrophobicContact CB-CZ 4.47Å; L316-F444 HydrophobicContact CD1-CD1 4.2Å; L316-F444 HydrophobicContact CD1-CE1 3.33Å; L316-F444 HydrophobicContact CD1-CZ 3.55Å; L316-F444 HydrophobicContact CG-CD1 4.22Å; L316-F444 HydrophobicContact CG-CE1 3.69Å; L316-F444 HydrophobicContact CG-CE2 4.28Å; L316-F444 HydrophobicContact CG-CZ 3.73Å; L316-L450 HydrophobicContact CD1-CD1 4.48Å; L316-L450 HydrophobicContact CD2-CD1 3.85Å; L316-L489 HydrophobicContact CD1-CD1 4.4Å; L316-A494 HydrophobicContact CD1-CB 4.47Å; L316-F498 HydrophobicContact CD2-CB 3.46Å; L316-F498 VanDerWaalsContact CD2-CB 3.46Å; L316-F498 HydrophobicContact CD2-CD1 3.89Å; L316-F498 HydrophobicContact CD2-CD2 4.16Å; L316-F498 HydrophobicContact CD2-CG 3.57Å
317	Q	91	Very high	94.3	Very high	44 Å²	44	20.5 Å²	20.5	21%	0.206	12%	0.115	C	C	.	.			trans	-105.3	137.4	172.9	-175	178.1	-20.6	0	0	110.1	M319 F497	Q317-M319 HydrophobicContact CB-CE 3.62Å; Q317-M319 HydrophobicContact CG-CE 3.5Å; Q317-M319 WeakPolarHBondContact O-CE 3.42Å; Q317-M319 PolarHBondContact O-N 3.48Å; Q317-F497 HydrophobicContact CB-CD1 4.05Å; Q317-F497 HydrophobicContact CB-CE1 3.64Å; Q317-F497 HydrophobicContact CB-CZ 4.31Å; Q317-F497 HydrophobicContact CG-CE1 4.31Å
318	Y	91.6	Very high	94.1	Very high	19 Å²	19	20.3 Å²	20.3	8%	0.075	11%	0.114	C	C	.	.			trans	-72.8	122.5	175.7	-165.4	-111.3	0	0	0	110.7	I286 T310 L313 F320 A322 F343 L344	I286-Y318 HydrophobicContact CG2-CD2 3.89Å; I286-Y318 HydrophobicContact CG2-CE2 3.69Å; T310-Y318 HydrophobicContact CG2-CD1 4.2Å; T310-Y318 HydrophobicContact CG2-CG 4.27Å; L313-Y318 HydrophobicContact CD1-CD2 3.89Å; L313-Y318 HydrophobicContact CD1-CG 4.33Å; Y318-F320 HydrophobicContact CD1-CB 4.47Å; Y318-F320 VanDerWaalsContact CD1-O 3.25Å; Y318-F320 WeakPolarHBondContact CD1-O 3.48Å; Y318-F320 HydrophobicContact CE1-CB 3.78Å; Y318-F320 WeakPolarHBondContact CE1-O 3.36Å; Y318-F320 HydrophobicContact CE2-CD2 4.28Å; Y318-A322 HydrophobicContact CD1-CB 4.01Å; Y318-A322 HydrophobicContact CE1-CB 4.05Å; Y318-F343 WeakPolarHBondContact OH-CA 3.46Å; Y318-F343 PolarHBondContact OH-O 2.93Å; Y318-L344 HydrophobicContact CE1-CB 4.03Å; Y318-L344 PolarHBondContact OH-N 3.2Å
319	M	86.4	Confident	93.5	Very high	57 Å²	57	21.7 Å²	21.7	28%	0.281	12%	0.124	S	C	.	.			trans	-92.5	-7.8	-172.3	-70.5	-64.4	105.2	0	0	115	Q317 Q493 F497	Q317-M319 HydrophobicContact CB-CE 3.62Å; Q317-M319 HydrophobicContact CG-CE 3.5Å; Q317-M319 WeakPolarHBondContact O-CE 3.42Å; Q317-M319 PolarHBondContact O-N 3.48Å; M319-Q493 HydrophobicContact CB-CG 4.48Å; M319-Q493 HydrophobicContact CG-CG 4.21Å; M319-F497 HydrophobicContact CE-CB 4.41Å; M319-F497 HydrophobicContact CE-CD1 3.81Å; M319-F497 HydrophobicContact CE-CD2 3.5Å; M319-F497 HydrophobicContact CE-CE1 3.85Å; M319-F497 HydrophobicContact CE-CE2 3.48Å; M319-F497 VanDerWaalsContact CE-CE2 3.48Å; M319-F497 HydrophobicContact CE-CG 3.64Å; M319-F497 HydrophobicContact CE-CZ 3.67Å; M319-F497 HydrophobicContact CG-CB 4.46Å; M319-F497 HydrophobicContact SD-CB 4.1Å; M319-F497 HydrophobicContact SD-CD1 4.5Å; M319-F497 HydrophobicContact SD-CD2 3.32Å; M319-F497 WeakPolarHBondContact SD-CD2 3.45Å; M319-F497 HydrophobicContact SD-CE2 3.74Å; M319-F497 HydrophobicContact SD-CG 3.73Å
320	F	93	Very high	92.9	Very high	43 Å²	43	23.5 Å²	23.5	19%	0.189	13%	0.134	C	C	.	.	S	Bend	trans	-116	171.7	-166.8	-56.8	-78.2	0	0	0	112.6	E289 Y318 A322 P342 Q493	E289-F320 HydrophobicContact CB-CE2 4.04Å; E289-F320 HydrophobicContact CB-CZ 4.48Å; E289-F320 VanDerWaalsContact CD-CE2 3.41Å; E289-F320 HydrophobicContact CG-CE2 3.68Å; E289-F320 HydrophobicContact CG-CZ 4.32Å; E289-F320 WeakPolarHBondContact OE1-CE2 3.26Å; Y318-F320 HydrophobicContact CD1-CB 4.47Å; Y318-F320 VanDerWaalsContact CD1-O 3.25Å; Y318-F320 WeakPolarHBondContact CD1-O 3.48Å; Y318-F320 HydrophobicContact CE1-CB 3.78Å; Y318-F320 WeakPolarHBondContact CE1-O 3.36Å; Y318-F320 HydrophobicContact CE2-CD2 4.28Å; F320-A322 PolarHBondContact O-N 2.72Å; F320-A322 VanDerWaalsContact O-N 3.12Å; F320-P342 HydrophobicContact CB-CB 4.31Å; F320-P342 WeakPolarHBondContact CB-O 3.3Å; F320-P342 HydrophobicContact CD1-CB 3.95Å; F320-P342 HydrophobicContact CD1-CG 3.96Å; F320-P342 HydrophobicContact CD2-CB 3.85Å; F320-P342 HydrophobicContact CD2-CG 4.25Å; F320-P342 HydrophobicContact CE1-CB 4.23Å; F320-P342 HydrophobicContact CE1-CG 3.76Å; F320-P342 HydrophobicContact CE2-CB 4.15Å; F320-P342 HydrophobicContact CE2-CG 4.07Å; F320-P342 HydrophobicContact CG-CB 3.75Å; F320-P342 HydrophobicContact CG-CG 4.21Å; F320-P342 HydrophobicContact CZ-CB 4.33Å; F320-P342 HydrophobicContact CZ-CG 3.81Å; F320-Q493 HydrophobicContact CZ-CB 4.2Å
321	P	92.7	Very high	92.4	Very high	69 Å²	69	29.7 Å²	29.7	45%	0.448	16%	0.157	S	C	.	.			trans	-57.5	117.5	176.5	-26.8	36.9	0	0	0	112.5	F343 L344	P321-F343 WeakPolarHBondContact O-CA 3.17Å; P321-L344 PolarHBondContact O-N 2.99Å
322	A	94.5	Very high	92	Very high	35 Å²	35	30 Å²	30	29%	0.289	16%	0.162	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	114.8	169.9	0	0	0	0	0	109.1	T310 Y318 F320 L344	T310-A322 HydrophobicContact CG2-CB 3.93Å; Y318-A322 HydrophobicContact CD1-CB 4.01Å; Y318-A322 HydrophobicContact CE1-CB 4.05Å; F320-A322 PolarHBondContact O-N 2.72Å; F320-A322 VanDerWaalsContact O-N 3.12Å; A322-L344 CarbonylContact C-O 3.53Å; A322-L344 VanDerWaalsContact CA-O 3.3Å; A322-L344 WeakPolarHBondContact CA-O 3.31Å
323	I	95.3	Very high	91.6	Very high	36 Å²	36	30 Å²	30	19%	0.185	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	104	-177.7	-54.9	179	0	0	0	108.1	L325 L326 L336 L344 I345 G346	I323-L325 VanDerWaalsContact C-N 3.26Å; I323-L325 PolarHBondContact O-N 2.94Å; I323-L326 HydrophobicContact CG2-CB 4.29Å; I323-L336 HydrophobicContact CD1-CD1 3.99Å; I323-L344 PolarHBondContact N-O 2.92Å; I323-I345 HydrophobicContact CB-CG1 4.14Å; I323-I345 HydrophobicContact CB-CG2 4.33Å; I323-I345 HydrophobicContact CD1-CD1 4.13Å; I323-I345 HydrophobicContact CD1-CG1 4.17Å; I323-I345 HydrophobicContact CG1-CG1 4.25Å; I323-I345 WeakPolarHBondContact O-CA 3.17Å; I323-G346 PolarHBondContact O-N 2.91Å
324	P	96	Very high	91.4	Very high	5 Å²	5	31.6 Å²	31.6	3%	0.032	17%	0.17	C	C	.	.	S	Bend	trans	-60.8	-31.1	-177.5	-26.6	36.3	0	0	0	114.6	T84 T303 V306 M307	T84-P324 HydrophobicContact CG2-CG 4.32Å; T84-P324 WeakPolarHBondContact OG1-CD 3.5Å; T84-P324 WeakPolarHBondContact OG1-CG 3.45Å; T303-P324 HydrophobicContact CG2-CB 3.97Å; T303-P324 WeakPolarHBondContact CG2-O 3.36Å; V306-P324 HydrophobicContact CB-CB 4.36Å; V306-P324 HydrophobicContact CG1-CB 4.39Å; V306-P324 HydrophobicContact CG1-CG 4.33Å; M307-P324 HydrophobicContact CG-CB 4.36Å; M307-P324 HydrophobicContact CG-CG 3.89Å; M307-P324 HydrophobicContact SD-CG 4.32Å
325	L	96.2	Very high	91.2	Very high	1 Å²	1	35 Å²	35	1%	0.005	19%	0.191	C	C	.	.			trans	-150.5	116.2	176.9	178.3	66.3	0	0	0	110.1	F60 P63 F81 Y299 L302 T303 I323 P327 G346 P348	F60-L325 WeakPolarHBondContact CD1-O 3.38Å; F60-L325 VanDerWaalsContact CE1-O 3.24Å; F60-L325 WeakPolarHBondContact CE1-O 3.32Å; P63-L325 HydrophobicContact CB-CD2 4.15Å; P63-L325 HydrophobicContact CG-CD2 4.19Å; F81-L325 HydrophobicContact CD2-CD2 3.91Å; F81-L325 HydrophobicContact CE2-CD2 3.66Å; Y299-L325 HydrophobicContact CD1-CD1 4.41Å; L302-L325 HydrophobicContact CD2-CD1 3.96Å; T303-L325 HydrophobicContact CG2-CB 3.62Å; I323-L325 VanDerWaalsContact C-N 3.26Å; I323-L325 PolarHBondContact O-N 2.94Å; L325-P327 WeakPolarHBondContact O-CD 3.27Å; L325-G346 CarbonylContact C-O 3.6Å; L325-G346 WeakPolarHBondContact CA-O 3.39Å; L325-P348 HydrophobicContact CD1-CG 3.92Å
326	L	95.4	Very high	91.1	Very high	2 Å²	2	38.6 Å²	38.6	1%	0.01	21%	0.209	C	C	.	.			trans	-96.9	107.6	167.9	174.6	61.6	0	0	0	108.6	I323 L330 L336 L337 I345 G346 I347 P348 F351	I323-L326 HydrophobicContact CG2-CB 4.29Å; L326-L330 HydrophobicContact CD1-CD2 4.05Å; L326-L336 HydrophobicContact CD1-CD1 3.83Å; L326-L337 HydrophobicContact CD2-CD2 4.41Å; L326-I345 HydrophobicContact CB-CG2 3.81Å; L326-I345 HydrophobicContact CD2-CG2 3.94Å; L326-G346 PolarHBondContact N-O 3.23Å; L326-I347 HydrophobicContact CB-CG2 4.2Å; L326-I347 HydrophobicContact CD2-CG2 4.23Å; L326-P348 VanDerWaalsContact O-CD 3.25Å; L326-P348 WeakPolarHBondContact O-CD 3.43Å; L326-F351 HydrophobicContact CD2-CE2 4.02Å; L326-F351 HydrophobicContact CD2-CZ 3.86Å; L326-F351 HydrophobicContact CG-CE2 3.86Å; L326-F351 HydrophobicContact CG-CZ 4.22Å
327	P	92.4	Very high	91.1	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	21%	0.207	C	C	.	.			trans	-72.3	141.7	-174.7	27	-34.8	0	0	0	113.2	Y59 F60 P63 L325 S329 L330	Y59-P327 VanDerWaalsContact O-CB 3.25Å; Y59-P327 WeakPolarHBondContact O-CB 3.31Å; F60-P327 HydrophobicContact CD1-CG 4.17Å; F60-P327 HydrophobicContact CD2-CG 4.29Å; F60-P327 HydrophobicContact CE1-CG 4.17Å; F60-P327 HydrophobicContact CE2-CG 4.27Å; F60-P327 HydrophobicContact CG-CG 4.24Å; F60-P327 HydrophobicContact CZ-CG 4.21Å; P63-P327 HydrophobicContact CB-CB 3.68Å; L325-P327 WeakPolarHBondContact O-CD 3.27Å; P327-S329 PolarHBondContact O-N 2.87Å; P327-L330 HydrophobicContact CG-CB 4.02Å; P327-L330 PolarHBondContact O-N 3.4Å
328	N	90.1	Very high	91.2	Very high	9 Å²	9	40.6 Å²	40.6	5%	0.048	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-35.9	176.5	-55.8	7.2	0	0	0	111.6	P63 L330 P348 T350 F351 Q354 K355	P63-N328 WeakPolarHBondContact O-CB 3.25Å; P63-N328 PolarHBondContact O-N 2.84Å; N328-L330 PolarHBondContact O-N 2.96Å; N328-P348 WeakPolarHBondContact OD1-CB 3.35Å; N328-P348 WeakPolarHBondContact OD1-CD 3.18Å; N328-P348 VanDerWaalsContact OD1-CG 3.22Å; N328-P348 WeakPolarHBondContact OD1-CG 3.05Å; N328-T350 PolarHBondContact ND2-OG1 3.27Å; N328-F351 HydrophobicContact CB-CD2 4.4Å; N328-F351 WeakPolarHBondContact OD1-CA 3.48Å; N328-F351 WeakPolarHBondContact OD1-CB 3.38Å; N328-F351 VanDerWaalsContact OD1-CD2 3.29Å; N328-F351 WeakPolarHBondContact OD1-CD2 3.32Å; N328-Q354 PolarHBondContact ND2-OE1 3.11Å; N328-K355 WeakPolarHBondContact O-CE 3.49Å; N328-K355 PolarHBondContact O-NZ 3.42Å
329	S	84.5	Confident	91.2	Very high	30 Å²	30	41.2 Å²	41.2	21%	0.21	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.9	-15.4	-177.1	60.1	0	0	0	0	114	Q62 P63 P327 K331	Q62-S329 PolarHBondContact O-OG 2.77Å; P63-S329 PolarHBondContact O-N 3.45Å; P63-S329 PolarHBondContact O-OG 2.92Å; P327-S329 PolarHBondContact O-N 2.87Å; S329-K331 PolarHBondContact O-N 3.25Å
330	L	86.7	Confident	91.5	Very high	37 Å²	37	44.2 Å²	44.2	19%	0.194	25%	0.251	C	S	.	.	S	Bend	trans	-74.6	119.5	173.6	-173.9	66.9	0	0	0	110.7	Y59 L326 P327 N328 G332 G333 K355	Y59-L330 HydrophobicContact CD2-CD1 4.09Å; Y59-L330 HydrophobicContact CE2-CD1 4.46Å; L326-L330 HydrophobicContact CD1-CD2 4.05Å; P327-L330 HydrophobicContact CG-CB 4.02Å; P327-L330 PolarHBondContact O-N 3.4Å; N328-L330 PolarHBondContact O-N 2.96Å; L330-G332 PolarHBondContact O-N 3.3Å; L330-G333 PolarHBondContact O-N 3.47Å; L330-K355 PolarHBondContact O-NZ 3.34Å
331	K	83.6	Confident	91.5	Very high	171 Å²	171	45 Å²	45	74%	0.743	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.5	125.6	179.4	-66.8	-178.9	178.6	178.6	0	110.2	S329 G333	S329-K331 PolarHBondContact O-N 3.25Å; K331-G333 PolarHBondContact O-N 3.21Å
332	G	87	Confident	91.6	Very high	28 Å²	28	42.9 Å²	42.9	29%	0.289	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	72.8	7.5	-179.1	0	0	0	0	0	115.2	L330 E334 N335	L330-G332 PolarHBondContact O-N 3.3Å; G332-E334 WeakPolarHBondContact CA-OE2 3.34Å; G332-E334 PolarHBondContact O-N 3.15Å; G332-N335 WeakPolarHBondContact CA-ND2 3.44Å; G332-N335 VanDerWaalsContact O-CB 3.32Å; G332-N335 WeakPolarHBondContact O-CB 3.49Å; G332-N335 PolarHBondContact O-N 3.49Å; G332-N335 PolarHBondContact O-ND2 3.49Å
333	G	86.8	Confident	91.7	Very high	3 Å²	3	41.3 Å²	41.3	3%	0.031	23%	0.232	C	C	.	.	G	3₁₀ helix	trans	-59.4	-29.6	177.8	0	0	0	0	0	113.3	L330 K331 N335 L336	L330-G333 PolarHBondContact O-N 3.47Å; K331-G333 PolarHBondContact O-N 3.21Å; G333-N335 PolarHBondContact O-N 3.35Å; G333-N335 VanDerWaalsContact O-N 3.15Å; G333-L336 WeakPolarHBondContact O-CB 3.27Å; G333-L336 WeakPolarHBondContact O-CG 3.39Å; G333-L336 PolarHBondContact O-N 3.33Å
334	E	91	Very high	91.9	Very high	38 Å²	38	39.6 Å²	39.6	18%	0.178	22%	0.224	C	C	.	.	G	3₁₀ helix	trans	-56.4	-25.3	173.1	62	-83.7	-165.6	0	0	113.7	G332 L336 L337 F351 K355 F358	G332-E334 WeakPolarHBondContact CA-OE2 3.34Å; G332-E334 PolarHBondContact O-N 3.15Å; E334-L336 PolarHBondContact O-N 3.39Å; E334-L337 WeakPolarHBondContact O-CB 3.29Å; E334-L337 PolarHBondContact O-N 2.89Å; E334-F351 HydrophobicContact CB-CE1 4.07Å; E334-F351 HydrophobicContact CB-CZ 4.02Å; E334-K355 HydrophobicContact CG-CD 4.5Å; E334-K355 IonicContact OE1-NZ 2.72Å; E334-K355 WeakPolarHBondContact OE2-CE 3.47Å; E334-K355 IonicContact OE2-NZ 3.74Å; E334-K355 PolarHBondContact OE2-NZ 3.12Å; E334-F358 HydrophobicContact CB-CB 4.49Å; E334-F358 HydrophobicContact CB-CD1 4.42Å; E334-F358 HydrophobicContact CB-CD2 3.7Å; E334-F358 HydrophobicContact CB-CE2 3.97Å; E334-F358 HydrophobicContact CB-CG 3.94Å; E334-F358 HydrophobicContact CB-CZ 4.46Å; E334-F358 HydrophobicContact CG-CB 4.41Å; E334-F358 HydrophobicContact CG-CD2 3.79Å; E334-F358 HydrophobicContact CG-CE2 4.38Å; E334-F358 HydrophobicContact CG-CG 4.22Å; E334-F358 VanDerWaalsContact O-CE2 3.3Å; E334-F358 WeakPolarHBondContact O-CE2 3.41Å
335	N	91.7	Very high	92	Very high	96 Å²	96	39.4 Å²	39.4	51%	0.513	22%	0.223	S	C	.	.	G	3₁₀ helix	trans	-67.3	-21.5	176.2	-62.9	-61.6	0	0	0	112.9	G332 G333 L337 L338	G332-N335 WeakPolarHBondContact CA-ND2 3.44Å; G332-N335 VanDerWaalsContact O-CB 3.32Å; G332-N335 WeakPolarHBondContact O-CB 3.49Å; G332-N335 PolarHBondContact O-N 3.49Å; G332-N335 PolarHBondContact O-ND2 3.49Å; G333-N335 PolarHBondContact O-N 3.35Å; G333-N335 VanDerWaalsContact O-N 3.15Å; N335-L337 PolarHBondContact O-N 2.98Å; N335-L338 WeakPolarHBondContact O-CB 3.34Å; N335-L338 PolarHBondContact O-N 3.14Å
336	L	92.2	Very high	92	Very high	80 Å²	80	39.4 Å²	39.4	42%	0.419	22%	0.222	S	C	.	.	G	3₁₀ helix	trans	-64.4	-30.3	175	-62.9	173	0	0	0	111.7	I323 L326 G333 E334 L338 S339 I345	I323-L336 HydrophobicContact CD1-CD1 3.99Å; L326-L336 HydrophobicContact CD1-CD1 3.83Å; G333-L336 WeakPolarHBondContact O-CB 3.27Å; G333-L336 WeakPolarHBondContact O-CG 3.39Å; G333-L336 PolarHBondContact O-N 3.33Å; E334-L336 PolarHBondContact O-N 3.39Å; L336-L338 PolarHBondContact O-N 3.38Å; L336-S339 WeakPolarHBondContact O-CB 3.32Å; L336-S339 PolarHBondContact O-N 3.26Å; L336-I345 HydrophobicContact CB-CD1 4.35Å
337	L	94.2	Very high	92.1	Very high	1 Å²	1	39.3 Å²	39.3	1%	0.005	22%	0.222	C	C	.	.	G	3₁₀ helix	trans	-69.8	-13.6	175.1	-53.9	-177.3	0	0	0	112.5	V293 L326 E334 N335 F343 I345 F351 F358	V293-L337 HydrophobicContact CG2-CD2 3.85Å; L326-L337 HydrophobicContact CD2-CD2 4.41Å; E334-L337 WeakPolarHBondContact O-CB 3.29Å; E334-L337 PolarHBondContact O-N 2.89Å; N335-L337 PolarHBondContact O-N 2.98Å; L337-F343 HydrophobicContact CD2-CE2 4.21Å; L337-F343 WeakPolarHBondContact O-CZ 3.45Å; L337-I345 HydrophobicContact CD2-CB 4.24Å; L337-I345 HydrophobicContact CD2-CD1 3.88Å; L337-I345 HydrophobicContact CD2-CG2 4.04Å; L337-F351 HydrophobicContact CD1-CE1 4.06Å; L337-F358 HydrophobicContact CB-CZ 3.9Å; L337-F358 HydrophobicContact CD1-CE1 3.9Å; L337-F358 HydrophobicContact CD1-CZ 4.03Å
338	L	93.2	Very high	92.3	Very high	92 Å²	92	39.3 Å²	39.3	48%	0.482	22%	0.222	S	C	.	.	G	3₁₀ helix	trans	-89.7	3.3	176.1	-52.9	-178.7	0	0	0	113.1	N335 L336 F358 P361	N335-L338 WeakPolarHBondContact O-CB 3.34Å; N335-L338 PolarHBondContact O-N 3.14Å; L336-L338 PolarHBondContact O-N 3.38Å; L338-F358 HydrophobicContact CD1-CE2 4.4Å; L338-F358 HydrophobicContact CD2-CE2 3.74Å; L338-F358 HydrophobicContact CD2-CZ 4.05Å; L338-F358 HydrophobicContact CG-CE2 4.02Å; L338-P361 HydrophobicContact CD2-CG 3.64Å
339	S	92.3	Very high	92.5	Very high	32 Å²	32	40.5 Å²	40.5	22%	0.224	23%	0.233	C	C	.	.			trans	-55.3	137.8	-178.9	-174.8	0	0	0	0	111.4	K291 L336 T341	K291-S339 VanDerWaalsContact CE-O 3.27Å; K291-S339 WeakPolarHBondContact CE-O 3.42Å; K291-S339 PolarHBondContact NZ-O 2.91Å; L336-S339 WeakPolarHBondContact O-CB 3.32Å; L336-S339 PolarHBondContact O-N 3.26Å; S339-T341 VanDerWaalsContact C-N 3.27Å; S339-T341 PolarHBondContact O-N 3.43Å; S339-T341 PolarHBondContact OG-N 3.11Å; S339-T341 PolarHBondContact OG-OG1 3.27Å
340	P	92.6	Very high	92.8	Very high	120 Å²	120	41 Å²	41	78%	0.779	24%	0.235	S	C	*	.	S	Bend	trans	-68.9	-27.7	172.8	28.9	-34.7	0	0	0	112	K291	K291-P340 WeakPolarHBondContact CE-O 3.43Å; K291-P340 PolarHBondContact NZ-O 3.28Å
341	T	93.3	Very high	93.2	Very high	59 Å²	59	39.2 Å²	39.2	36%	0.362	23%	0.226	S	C	.	.	S	Bend	trans	-75.5	160.7	179.8	67.9	0	0	0	0	111.9	K291 S339 F343	K291-T341 VanDerWaalsContact CE-O 3.29Å; K291-T341 WeakPolarHBondContact CE-O 3.36Å; S339-T341 VanDerWaalsContact C-N 3.27Å; S339-T341 PolarHBondContact O-N 3.43Å; S339-T341 PolarHBondContact OG-N 3.11Å; S339-T341 PolarHBondContact OG-OG1 3.27Å; T341-F343 WeakPolarHBondContact O-CD1 3.4Å
342	P	95.4	Very high	93.5	Very high	25 Å²	25	33.4 Å²	33.4	16%	0.162	20%	0.202	C	C	.	.			trans	-54.1	155.9	161.8	-21.6	33.2	0	0	0	111.8	E289 F320	E289-P342 HydrophobicContact CB-CB 4.32Å; E289-P342 HydrophobicContact CB-CG 3.94Å; E289-P342 VanDerWaalsContact O-CB 3.3Å; E289-P342 WeakPolarHBondContact O-CB 3.3Å; E289-P342 WeakPolarHBondContact O-CG 3.39Å; F320-P342 HydrophobicContact CB-CB 4.31Å; F320-P342 WeakPolarHBondContact CB-O 3.3Å; F320-P342 HydrophobicContact CD1-CB 3.95Å; F320-P342 HydrophobicContact CD1-CG 3.96Å; F320-P342 HydrophobicContact CD2-CB 3.85Å; F320-P342 HydrophobicContact CD2-CG 4.25Å; F320-P342 HydrophobicContact CE1-CB 4.23Å; F320-P342 HydrophobicContact CE1-CG 3.76Å; F320-P342 HydrophobicContact CE2-CB 4.15Å; F320-P342 HydrophobicContact CE2-CG 4.07Å; F320-P342 HydrophobicContact CG-CB 3.75Å; F320-P342 HydrophobicContact CG-CG 4.21Å; F320-P342 HydrophobicContact CZ-CB 4.33Å; F320-P342 HydrophobicContact CZ-CG 3.81Å
343	F	96.9	Very high	93.6	Very high	2 Å²	2	36.1 Å²	36.1	1%	0.009	22%	0.217	C	C	.	.			trans	-163.3	161	174.2	56.5	-105.5	0	0	0	111.5	K291 V292 V293 Y318 P321 L337 T341 I345 V364	K291-F343 HydrophobicContact CB-CD1 4.39Å; K291-F343 HydrophobicContact CB-CE1 4.03Å; K291-F343 HydrophobicContact CB-CE2 4.14Å; K291-F343 HydrophobicContact CB-CZ 3.9Å; K291-F343 HydrophobicContact CD-CD1 4.33Å; K291-F343 HydrophobicContact CD-CE1 3.71Å; K291-F343 HydrophobicContact CD-CZ 4.18Å; K291-F343 HydrophobicContact CG-CD1 4.03Å; K291-F343 HydrophobicContact CG-CE1 3.81Å; K291-F343 HydrophobicContact CG-CZ 4.2Å; V292-F343 PolarHBondContact N-O 3.06Å; V293-F343 HydrophobicContact CG2-CE2 3.86Å; Y318-F343 WeakPolarHBondContact OH-CA 3.46Å; Y318-F343 PolarHBondContact OH-O 2.93Å; P321-F343 WeakPolarHBondContact O-CA 3.17Å; L337-F343 HydrophobicContact CD2-CE2 4.21Å; L337-F343 WeakPolarHBondContact O-CZ 3.45Å; T341-F343 WeakPolarHBondContact O-CD1 3.4Å; F343-I345 HydrophobicContact CB-CD1 4.15Å; F343-I345 HydrophobicContact CB-CG1 4.23Å; F343-I345 HydrophobicContact CD2-CB 4.27Å; F343-I345 HydrophobicContact CD2-CD1 3.56Å; F343-I345 HydrophobicContact CD2-CG1 3.7Å; F343-I345 HydrophobicContact CE2-CD1 4.05Å; F343-I345 HydrophobicContact CE2-CG1 4.43Å; F343-I345 HydrophobicContact CG-CD1 3.89Å; F343-I345 HydrophobicContact CG-CG1 4.24Å; F343-V364 HydrophobicContact CE2-CG1 4.21Å; F343-V364 HydrophobicContact CZ-CG1 4.23Å; F343-V364 HydrophobicContact CZ-CG2 3.89Å
344	L	97.8	Very high	93.5	Very high	0 Å²	0	40 Å²	40	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	105.4	173	-176.5	67.4	0	0	0	109.2	I286 V292 L294 V306 F309 T310 Y318 P321 A322 I323	I286-L344 HydrophobicContact CD1-CD1 3.64Å; I286-L344 HydrophobicContact CD1-CD2 4.09Å; I286-L344 HydrophobicContact CG1-CD1 4.01Å; V292-L344 HydrophobicContact CB-CD1 3.82Å; V292-L344 HydrophobicContact CG1-CD1 3.88Å; V292-L344 WeakPolarHBondContact O-CA 3.27Å; L294-L344 HydrophobicContact CD1-CD1 3.39Å; L294-L344 HydrophobicContact CD1-CG 4.26Å; V306-L344 HydrophobicContact CG1-CD2 4Å; V306-L344 HydrophobicContact CG1-CG 4.11Å; F309-L344 HydrophobicContact CB-CD2 4.23Å; T310-L344 HydrophobicContact CG2-CD2 3.68Å; Y318-L344 HydrophobicContact CE1-CB 4.03Å; Y318-L344 PolarHBondContact OH-N 3.2Å; P321-L344 PolarHBondContact O-N 2.99Å; A322-L344 CarbonylContact C-O 3.53Å; A322-L344 VanDerWaalsContact CA-O 3.3Å; A322-L344 WeakPolarHBondContact CA-O 3.31Å; I323-L344 PolarHBondContact N-O 2.92Å
345	I	97.8	Very high	93.2	Very high	2 Å²	2	39.9 Å²	39.9	1%	0.01	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	124.6	-170.9	-62.2	175.7	0	0	0	110.6	V292 V293 L294 I323 L326 L336 L337 F343 I347	V292-I345 PolarHBondContact O-N 2.65Å; V293-I345 CarbonylContact C-O 3.52Å; V293-I345 VanDerWaalsContact CA-O 3.24Å; V293-I345 WeakPolarHBondContact CA-O 3.48Å; L294-I345 PolarHBondContact N-O 3.4Å; I323-I345 HydrophobicContact CB-CG1 4.14Å; I323-I345 HydrophobicContact CB-CG2 4.33Å; I323-I345 HydrophobicContact CD1-CD1 4.13Å; I323-I345 HydrophobicContact CD1-CG1 4.17Å; I323-I345 HydrophobicContact CG1-CG1 4.25Å; I323-I345 WeakPolarHBondContact O-CA 3.17Å; L326-I345 HydrophobicContact CB-CG2 3.81Å; L326-I345 HydrophobicContact CD2-CG2 3.94Å; L336-I345 HydrophobicContact CB-CD1 4.35Å; L337-I345 HydrophobicContact CD2-CB 4.24Å; L337-I345 HydrophobicContact CD2-CD1 3.88Å; L337-I345 HydrophobicContact CD2-CG2 4.04Å; F343-I345 HydrophobicContact CB-CD1 4.15Å; F343-I345 HydrophobicContact CB-CG1 4.23Å; F343-I345 HydrophobicContact CD2-CB 4.27Å; F343-I345 HydrophobicContact CD2-CD1 3.56Å; F343-I345 HydrophobicContact CD2-CG1 3.7Å; F343-I345 HydrophobicContact CE2-CD1 4.05Å; F343-I345 HydrophobicContact CE2-CG1 4.43Å; F343-I345 HydrophobicContact CG-CD1 3.89Å; F343-I345 HydrophobicContact CG-CG1 4.24Å; I345-I347 HydrophobicContact CG2-CG2 4.15Å
346	G	98.1	Very high	92.7	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	130	168.3	0	0	0	0	0	111.4	L294 I323 L325 L326	L294-G346 CarbonylContact O-C 3.56Å; L294-G346 WeakPolarHBondContact O-CA 3.49Å; I323-G346 PolarHBondContact O-N 2.91Å; L325-G346 CarbonylContact C-O 3.6Å; L325-G346 WeakPolarHBondContact CA-O 3.39Å; L326-G346 PolarHBondContact N-O 3.23Å
347	I	96.9	Very high	92.3	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	146.6	173.1	60	175.3	0	0	0	111.4	V293 L294 Q295 L302 L326 I345 F351 L352	V293-I347 HydrophobicContact CG1-CD1 3.52Å; V293-I347 HydrophobicContact CG1-CG1 3.63Å; V293-I347 HydrophobicContact CG1-CG2 4.35Å; L294-I347 WeakPolarHBondContact O-CG1 3.16Å; L294-I347 PolarHBondContact O-N 3.42Å; Q295-I347 WeakPolarHBondContact CA-O 3.41Å; Q295-I347 HydrophobicContact CB-CG1 3.98Å; L302-I347 VanDerWaalsContact CD2-O 3.25Å; L302-I347 WeakPolarHBondContact CD2-O 3.23Å; L326-I347 HydrophobicContact CB-CG2 4.2Å; L326-I347 HydrophobicContact CD2-CG2 4.23Å; I345-I347 HydrophobicContact CG2-CG2 4.15Å; I347-F351 HydrophobicContact CB-CB 3.87Å; I347-F351 HydrophobicContact CB-CD1 4.38Å; I347-F351 HydrophobicContact CB-CD2 4.33Å; I347-F351 HydrophobicContact CB-CG 3.96Å; I347-F351 HydrophobicContact CD1-CB 4.22Å; I347-F351 HydrophobicContact CD1-CD1 4.19Å; I347-F351 HydrophobicContact CD1-CG 4.43Å; I347-F351 HydrophobicContact CG1-CB 4.41Å; I347-F351 HydrophobicContact CG2-CD1 4.17Å; I347-F351 HydrophobicContact CG2-CD2 4.21Å; I347-F351 HydrophobicContact CG2-CE1 4.47Å; I347-F351 HydrophobicContact CG2-CG 4.06Å; I347-L352 HydrophobicContact CD1-CD1 4.02Å; I347-L352 HydrophobicContact CD1-CD2 4.12Å; I347-L352 HydrophobicContact CD1-CG 3.76Å
348	P	95.9	Very high	92	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-54.8	143.8	164.2	-28.7	38.8	0	0	0	111.5	P63 Y299 L325 L326 N328 T350 F351	P63-P348 HydrophobicContact CB-CG 4.47Å; Y299-P348 HydrophobicContact CD1-CG 4.45Å; Y299-P348 HydrophobicContact CE1-CB 3.96Å; Y299-P348 HydrophobicContact CE1-CG 4.01Å; L325-P348 HydrophobicContact CD1-CG 3.92Å; L326-P348 VanDerWaalsContact O-CD 3.25Å; L326-P348 WeakPolarHBondContact O-CD 3.43Å; N328-P348 WeakPolarHBondContact OD1-CB 3.35Å; N328-P348 WeakPolarHBondContact OD1-CD 3.18Å; N328-P348 VanDerWaalsContact OD1-CG 3.22Å; N328-P348 WeakPolarHBondContact OD1-CG 3.05Å; P348-T350 WeakPolarHBondContact CB-OG1 3.32Å; P348-T350 PolarHBondContact O-N 3.47Å; P348-F351 WeakPolarHBondContact O-CB 3.35Å; P348-F351 PolarHBondContact O-N 3.14Å
349	A	94	Very high	91.8	Very high	34 Å²	34	52.8 Å²	52.8	28%	0.281	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.6	-18	174.1	0	0	0	0	0	113.7	S296 R297	S296-A349 PolarHBondContact O-N 3.2Å; R297-A349 HydrophobicContact CG-CB 3.8Å
350	T	92.4	Very high	91.7	Very high	41 Å²	41	54 Å²	54	25%	0.252	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.5	-12.7	174.2	50.5	0	0	0	0	113.9	E64 N328 P348 S353 Q354	E64-T350 WeakPolarHBondContact OE1-CG2 3.47Å; E64-T350 PolarHBondContact OE1-OG1 3.15Å; N328-T350 PolarHBondContact ND2-OG1 3.27Å; P348-T350 WeakPolarHBondContact CB-OG1 3.32Å; P348-T350 PolarHBondContact O-N 3.47Å; T350-S353 PolarHBondContact O-N 3.02Å; T350-S353 PolarHBondContact O-OG 3.22Å; T350-S353 VanDerWaalsContact O-OG 3.08Å; T350-Q354 WeakPolarHBondContact O-CB 3.47Å; T350-Q354 VanDerWaalsContact O-CG 3.31Å; T350-Q354 WeakPolarHBondContact O-CG 3.49Å; T350-Q354 PolarHBondContact O-N 3.16Å; T350-Q354 VanDerWaalsContact O-N 3.08Å
351	F	93.5	Very high	91.7	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-61.7	-53.4	-172.1	-173.6	-81.6	0	0	0	112.4	L326 N328 E334 L337 I347 P348 S353 Q354 K355	L326-F351 HydrophobicContact CD2-CE2 4.02Å; L326-F351 HydrophobicContact CD2-CZ 3.86Å; L326-F351 HydrophobicContact CG-CE2 3.86Å; L326-F351 HydrophobicContact CG-CZ 4.22Å; N328-F351 HydrophobicContact CB-CD2 4.4Å; N328-F351 WeakPolarHBondContact OD1-CA 3.48Å; N328-F351 WeakPolarHBondContact OD1-CB 3.38Å; N328-F351 VanDerWaalsContact OD1-CD2 3.29Å; N328-F351 WeakPolarHBondContact OD1-CD2 3.32Å; E334-F351 HydrophobicContact CB-CE1 4.07Å; E334-F351 HydrophobicContact CB-CZ 4.02Å; L337-F351 HydrophobicContact CD1-CE1 4.06Å; I347-F351 HydrophobicContact CB-CB 3.87Å; I347-F351 HydrophobicContact CB-CD1 4.38Å; I347-F351 HydrophobicContact CB-CD2 4.33Å; I347-F351 HydrophobicContact CB-CG 3.96Å; I347-F351 HydrophobicContact CD1-CB 4.22Å; I347-F351 HydrophobicContact CD1-CD1 4.19Å; I347-F351 HydrophobicContact CD1-CG 4.43Å; I347-F351 HydrophobicContact CG1-CB 4.41Å; I347-F351 HydrophobicContact CG2-CD1 4.17Å; I347-F351 HydrophobicContact CG2-CD2 4.21Å; I347-F351 HydrophobicContact CG2-CE1 4.47Å; I347-F351 HydrophobicContact CG2-CG 4.06Å; P348-F351 WeakPolarHBondContact O-CB 3.35Å; P348-F351 PolarHBondContact O-N 3.14Å; F351-S353 VanDerWaalsContact C-N 3.32Å; F351-S353 PolarHBondContact O-N 3.3Å; F351-Q354 PolarHBondContact O-N 3.05Å; F351-K355 HydrophobicContact CD1-CG 4.46Å; F351-K355 HydrophobicContact CE1-CG 4.3Å; F351-K355 VanDerWaalsContact O-CG 3.3Å; F351-K355 WeakPolarHBondContact O-CG 3.5Å; F351-K355 PolarHBondContact O-N 3.24Å
352	L	91.1	Very high	91.6	Very high	49 Å²	49	48.6 Å²	48.6	26%	0.257	26%	0.26	S	S	.	.	H	α-helix	trans	-69.2	-28	-176.8	-62.7	175.9	0	0	0	113	I347 F358 F360 L366	I347-L352 HydrophobicContact CD1-CD1 4.02Å; I347-L352 HydrophobicContact CD1-CD2 4.12Å; I347-L352 HydrophobicContact CD1-CG 3.76Å; L352-F358 HydrophobicContact CD2-CD1 4.4Å; L352-F358 HydrophobicContact CD2-CE1 4.39Å; L352-F360 HydrophobicContact CD1-CD2 4.15Å; L352-F360 HydrophobicContact CD1-CE2 4.4Å; L352-F360 HydrophobicContact CD2-CD2 3.76Å; L352-F360 HydrophobicContact CD2-CE2 4.38Å; L352-L366 HydrophobicContact CD1-CD2 4.07Å
353	S	88	Confident	91.6	Very high	85 Å²	85	51 Å²	51	59%	0.594	27%	0.271	S	S	*	.	H	α-helix	trans	-82	-25.7	178.6	56.5	0	0	0	0	113.2	T350 F351	T350-S353 PolarHBondContact O-N 3.02Å; T350-S353 PolarHBondContact O-OG 3.22Å; T350-S353 VanDerWaalsContact O-OG 3.08Å; F351-S353 VanDerWaalsContact C-N 3.32Å; F351-S353 PolarHBondContact O-N 3.3Å
354	Q	84.8	Confident	91.5	Very high	85 Å²	85	51 Å²	51	40%	0.397	27%	0.272	S	S	.	.	H	α-helix	trans	-81	-24.4	174.1	-72.2	-179.8	1.6	0	0	113.4	N328 T350 F351 T356	N328-Q354 PolarHBondContact ND2-OE1 3.11Å; T350-Q354 WeakPolarHBondContact O-CB 3.47Å; T350-Q354 VanDerWaalsContact O-CG 3.31Å; T350-Q354 WeakPolarHBondContact O-CG 3.49Å; T350-Q354 PolarHBondContact O-N 3.16Å; T350-Q354 VanDerWaalsContact O-N 3.08Å; F351-Q354 PolarHBondContact O-N 3.05Å; Q354-T356 PolarHBondContact O-N 3.05Å
355	K	86.2	Confident	91.5	Very high	34 Å²	34	52.5 Å²	52.5	15%	0.148	28%	0.277	C	S	.	.			trans	-96.4	64.9	-178.8	-59.4	-76.3	-178.6	159.3	0	111.1	N328 L330 E334 F351 D357 F358	N328-K355 WeakPolarHBondContact O-CE 3.49Å; N328-K355 PolarHBondContact O-NZ 3.42Å; L330-K355 PolarHBondContact O-NZ 3.34Å; E334-K355 HydrophobicContact CG-CD 4.5Å; E334-K355 IonicContact OE1-NZ 2.72Å; E334-K355 WeakPolarHBondContact OE2-CE 3.47Å; E334-K355 IonicContact OE2-NZ 3.74Å; E334-K355 PolarHBondContact OE2-NZ 3.12Å; F351-K355 HydrophobicContact CD1-CG 4.46Å; F351-K355 HydrophobicContact CE1-CG 4.3Å; F351-K355 VanDerWaalsContact O-CG 3.3Å; F351-K355 WeakPolarHBondContact O-CG 3.5Å; F351-K355 PolarHBondContact O-N 3.24Å; K355-D357 PolarHBondContact O-N 3.11Å; K355-D357 VanDerWaalsContact O-N 3.1Å; K355-F358 HydrophobicContact CB-CB 3.92Å; K355-F358 WeakPolarHBondContact O-CB 3.49Å; K355-F358 PolarHBondContact O-N 3.08Å
356	T	79.6	Confident	91.4	Very high	117 Å²	117	53.4 Å²	53.4	72%	0.718	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.4	-31.7	-172.7	53.7	0	0	0	0	115.1	Q354 F358	Q354-T356 PolarHBondContact O-N 3.05Å; T356-F358 VanDerWaalsContact C-N 3.32Å
357	D	83.7	Confident	91.4	Very high	162 Å²	162	53.4 Å²	53.4	87%	0.866	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.9	-6	-175.5	-55.8	-9.2	0	0	0	112.1	K355	K355-D357 PolarHBondContact O-N 3.11Å; K355-D357 VanDerWaalsContact O-N 3.1Å
358	F	87.9	Confident	91.4	Very high	38 Å²	38	54.7 Å²	54.7	17%	0.167	29%	0.289	C	S	.	.			trans	-90.4	122.8	-180	179.5	-102.9	0	0	0	111.5	E334 L337 L338 L352 K355 T356 F360	E334-F358 HydrophobicContact CB-CB 4.49Å; E334-F358 HydrophobicContact CB-CD1 4.42Å; E334-F358 HydrophobicContact CB-CD2 3.7Å; E334-F358 HydrophobicContact CB-CE2 3.97Å; E334-F358 HydrophobicContact CB-CG 3.94Å; E334-F358 HydrophobicContact CB-CZ 4.46Å; E334-F358 HydrophobicContact CG-CB 4.41Å; E334-F358 HydrophobicContact CG-CD2 3.79Å; E334-F358 HydrophobicContact CG-CE2 4.38Å; E334-F358 HydrophobicContact CG-CG 4.22Å; E334-F358 VanDerWaalsContact O-CE2 3.3Å; E334-F358 WeakPolarHBondContact O-CE2 3.41Å; L337-F358 HydrophobicContact CB-CZ 3.9Å; L337-F358 HydrophobicContact CD1-CE1 3.9Å; L337-F358 HydrophobicContact CD1-CZ 4.03Å; L338-F358 HydrophobicContact CD1-CE2 4.4Å; L338-F358 HydrophobicContact CD2-CE2 3.74Å; L338-F358 HydrophobicContact CD2-CZ 4.05Å; L338-F358 HydrophobicContact CG-CE2 4.02Å; L352-F358 HydrophobicContact CD2-CD1 4.4Å; L352-F358 HydrophobicContact CD2-CE1 4.39Å; K355-F358 HydrophobicContact CB-CB 3.92Å; K355-F358 WeakPolarHBondContact O-CB 3.49Å; K355-F358 PolarHBondContact O-N 3.08Å; T356-F358 VanDerWaalsContact C-N 3.32Å; F358-F360 HydrophobicContact CE1-CB 4.49Å; F358-F360 HydrophobicContact CE1-CD2 4.38Å
359	R	88.8	Confident	91.5	Very high	223 Å²	223	55 Å²	55	84%	0.842	29%	0.291	S	S	*	.			trans	-92.2	114	172.1	-174.5	178.1	-178.2	-178.6	1	110
360	F	91.3	Very high	91.6	Very high	57 Å²	57	56.4 Å²	56.4	25%	0.25	29%	0.294	C	S	.	.			trans	-56.2	129	173.6	-166.8	-97.4	0	0	0	111	V293 L352 F358 V364 L366	V293-F360 HydrophobicContact CB-CE2 4.44Å; V293-F360 HydrophobicContact CB-CZ 4.36Å; V293-F360 HydrophobicContact CG2-CE2 4.19Å; V293-F360 HydrophobicContact CG2-CZ 4.25Å; L352-F360 HydrophobicContact CD1-CD2 4.15Å; L352-F360 HydrophobicContact CD1-CE2 4.4Å; L352-F360 HydrophobicContact CD2-CD2 3.76Å; L352-F360 HydrophobicContact CD2-CE2 4.38Å; F358-F360 HydrophobicContact CE1-CB 4.49Å; F358-F360 HydrophobicContact CE1-CD2 4.38Å; F360-V364 HydrophobicContact CE1-CB 3.88Å; F360-V364 HydrophobicContact CE1-CG1 4.05Å; F360-V364 HydrophobicContact CE2-CG1 4.36Å; F360-V364 HydrophobicContact CZ-CB 3.89Å; F360-V364 HydrophobicContact CZ-CG1 3.55Å; F360-L366 HydrophobicContact CE1-CB 4.34Å; F360-L366 HydrophobicContact CZ-CB 4.06Å; F360-L366 HydrophobicContact CZ-CD1 4.49Å
361	P	92.5	Very high	91.7	Very high	20 Å²	20	56.7 Å²	56.7	13%	0.13	30%	0.3	C	S	.	.			trans	-64.9	150.6	-177.4	-25	36.4	0	0	0	113.3	L338 D363 V364	L338-P361 HydrophobicContact CD2-CG 3.64Å; P361-D363 VanDerWaalsContact C-N 3.32Å; P361-D363 WeakPolarHBondContact CB-OD1 3.35Å; P361-V364 HydrophobicContact CB-CG2 3.87Å; P361-V364 HydrophobicContact CG-CG2 4.27Å
362	A	91.7	Very high	91.7	Very high	46 Å²	46	59.8 Å²	59.8	38%	0.38	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.6	-15	-178.5	0	0	0	0	0	113.4	S377 L379 L380	A362-S377 WeakPolarHBondContact O-CB 3.32Å; A362-L379 HydrophobicContact CB-CD1 4.17Å; A362-L380 WeakPolarHBondContact O-CG 3.43Å
363	D	94.2	Very high	91.9	Very high	75 Å²	75	63.3 Å²	63.3	40%	0.401	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.5	19.3	-176.5	62.9	-44.8	0	0	0	113.3	K291 P361	K291-D363 WeakPolarHBondContact CE-OD2 3.31Å; K291-D363 IonicContact NZ-OD2 3.22Å; K291-D363 PolarHBondContact NZ-OD2 3.44Å; P361-D363 VanDerWaalsContact C-N 3.32Å; P361-D363 WeakPolarHBondContact CB-OD1 3.35Å
364	V	95.7	Very high	92.2	Very high	2 Å²	2	61.1 Å²	61.1	1%	0.012	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	134.6	-177.2	-178	0	0	0	0	110.3	K291 V293 F343 F360 P361	K291-V364 HydrophobicContact CB-CB 4.3Å; K291-V364 HydrophobicContact CB-CG1 4.24Å; K291-V364 HydrophobicContact CB-CG2 3.85Å; K291-V364 HydrophobicContact CD-CG2 3.94Å; V293-V364 HydrophobicContact CB-CG1 4.31Å; V293-V364 HydrophobicContact CG2-CG1 3.58Å; F343-V364 HydrophobicContact CE2-CG1 4.21Å; F343-V364 HydrophobicContact CZ-CG1 4.23Å; F343-V364 HydrophobicContact CZ-CG2 3.89Å; F360-V364 HydrophobicContact CE1-CB 3.88Å; F360-V364 HydrophobicContact CE1-CG1 4.05Å; F360-V364 HydrophobicContact CE2-CG1 4.36Å; F360-V364 HydrophobicContact CZ-CB 3.89Å; F360-V364 HydrophobicContact CZ-CG1 3.55Å; P361-V364 HydrophobicContact CB-CG2 3.87Å; P361-V364 HydrophobicContact CG-CG2 4.27Å
365	W	96.8	Very high	92.6	Very high	32 Å²	32	61 Å²	61	12%	0.121	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	130.3	171.9	-67.3	95.6	0	0	0	110.6	K291 V292 V293 M374 L380 I383	K291-W365 PolarHBondContact O-N 3.36Å; V292-W365 HydrophobicContact CG2-CB 4.48Å; V293-W365 PolarHBondContact N-O 3.11Å; W365-M374 HydrophobicContact CB-CE 3.73Å; W365-M374 HydrophobicContact CD2-CE 3.79Å; W365-M374 HydrophobicContact CE3-CE 3.98Å; W365-M374 HydrophobicContact CE3-CG 3.96Å; W365-M374 HydrophobicContact CE3-SD 4.44Å; W365-M374 HydrophobicContact CG-CE 3.69Å; W365-L380 HydrophobicContact CD2-CD1 3.88Å; W365-L380 HydrophobicContact CE3-CD1 4.33Å; W365-L380 HydrophobicContact CG-CD1 4.22Å; W365-L380 HydrophobicContact CH2-CB 4.33Å; W365-L380 HydrophobicContact CH2-CD1 4.48Å; W365-L380 HydrophobicContact CZ2-CB 3.83Å; W365-L380 HydrophobicContact CZ2-CD1 4.05Å; W365-L380 HydrophobicContact CZ2-CG 4.4Å; W365-I383 HydrophobicContact CD2-CD1 4.14Å; W365-I383 HydrophobicContact CE3-CD1 4.46Å; W365-I383 HydrophobicContact CH2-CD1 4.21Å; W365-I383 HydrophobicContact CZ2-CD1 3.83Å; W365-I383 HydrophobicContact CZ2-CG1 3.85Å
366	L	97.1	Very high	92.8	Very high	22 Å²	22	61.3 Å²	61.3	12%	0.115	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	119.8	174.3	-178.8	61.7	0	0	0	109.9	V293 Q295 L352 F360 M375	V293-L366 HydrophobicContact CB-CD1 4.11Å; V293-L366 HydrophobicContact CG1-CD1 3.75Å; V293-L366 CarbonylContact O-C 3.13Å; Q295-L366 HydrophobicContact CB-CD1 4.38Å; Q295-L366 HydrophobicContact CG-CD1 4.15Å; L352-L366 HydrophobicContact CD1-CD2 4.07Å; F360-L366 HydrophobicContact CE1-CB 4.34Å; F360-L366 HydrophobicContact CZ-CB 4.06Å; F360-L366 HydrophobicContact CZ-CD1 4.49Å; L366-M375 HydrophobicContact CD2-CE 3.96Å; L366-M375 HydrophobicContact CG-CE 4.15Å; L366-M375 PolarHBondContact N-O 2.84Å; L366-M375 PolarHBondContact O-N 3.37Å
367	V	97.7	Very high	93.1	Very high	0 Å²	0	57.7 Å²	57.7	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	115.1	179.1	-179.5	0	0	0	0	108.6	L274 V282 V292 V293 L294 Q295 K373 M374	L274-V367 HydrophobicContact CD1-CG1 3.89Å; L274-V367 HydrophobicContact CD2-CG1 4.11Å; V282-V367 HydrophobicContact CG1-CG2 4.18Å; V282-V367 HydrophobicContact CG2-CB 4.43Å; V282-V367 HydrophobicContact CG2-CG1 3.91Å; V282-V367 HydrophobicContact CG2-CG2 3.58Å; V292-V367 HydrophobicContact CG1-CG2 3.9Å; V293-V367 PolarHBondContact O-N 3.06Å; L294-V367 CarbonylContact C-O 3.32Å; L294-V367 WeakPolarHBondContact CA-O 3.49Å; L294-V367 HydrophobicContact CG-CB 4.19Å; L294-V367 HydrophobicContact CG-CG1 4.47Å; Q295-V367 PolarHBondContact N-O 3.12Å; V367-K373 CarbonylContact C-O 3.57Å; V367-K373 WeakPolarHBondContact CA-O 3.46Å; V367-M374 HydrophobicContact CG2-CE 4.45Å; V367-M374 HydrophobicContact CG2-CG 4.13Å
368	D	96.8	Very high	93.1	Very high	27 Å²	27	55.9 Å²	55.9	14%	0.144	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	108.5	174.2	-167.5	-39.8	0	0	0	109.3	Q295 D370 A371 N372 K373 M375	Q295-D368 HydrophobicContact CG-CB 4.05Å; Q295-D368 PolarHBondContact NE2-OD2 3.4Å; D368-D370 VanDerWaalsContact C-N 3.31Å; D368-D370 WeakPolarHBondContact OD1-CA 3.36Å; D368-D370 WeakPolarHBondContact OD1-CB 3.26Å; D368-D370 PolarHBondContact OD1-N 3.38Å; D368-A371 HydrophobicContact CB-CB 4.01Å; D368-A371 PolarHBondContact OD1-N 3.26Å; D368-N372 WeakPolarHBondContact O-CA 3.37Å; D368-N372 PolarHBondContact O-N 3.26Å; D368-N372 VanDerWaalsContact O-N 3.1Å; D368-K373 PolarHBondContact N-O 2.76Å; D368-K373 PolarHBondContact O-N 2.72Å; D368-K373 VanDerWaalsContact O-N 3.14Å; D368-M375 HydrophobicContact CB-CE 4.2Å
369	L	97.2	Very high	92.9	Very high	7 Å²	7	60.9 Å²	60.9	4%	0.037	33%	0.331	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.2	-30	178.4	-68.7	173.5	0	0	0	112	L273 L274 L294 Q295 L302	L273-L369 HydrophobicContact CB-CD2 4.42Å; L273-L369 HydrophobicContact CD1-CD2 4.32Å; L274-L369 HydrophobicContact CD1-CD2 3.95Å; L274-L369 HydrophobicContact CD2-CD2 3.98Å; L274-L369 HydrophobicContact CG-CD2 3.85Å; L294-L369 HydrophobicContact CD2-CD1 4.12Å; L294-L369 HydrophobicContact CD2-CD2 4.06Å; L294-L369 HydrophobicContact CD2-CG 4.23Å; Q295-L369 PolarHBondContact O-N 3.03Å; L302-L369 HydrophobicContact CD1-CD1 4.13Å
370	D	95.8	Very high	92.8	Very high	63 Å²	63	51.5 Å²	51.5	34%	0.337	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.1	-28	-177.8	-64.9	9.1	0	0	0	111.9	S296 R297 D368	S296-D370 WeakPolarHBondContact CA-OD1 3.49Å; S296-D370 VanDerWaalsContact CB-OD1 3.29Å; S296-D370 WeakPolarHBondContact CB-OD1 3.45Å; S296-D370 PolarHBondContact OG-OD1 2.96Å; R297-D370 WeakPolarHBondContact CB-OD2 3.29Å; R297-D370 WeakPolarHBondContact CG-OD2 3.39Å; R297-D370 IonicContact CZ-OD2 2.88Å; R297-D370 VanDerWaalsContact CZ-OD2 3.3Å; R297-D370 PolarHBondContact N-OD2 2.85Å; R297-D370 VanDerWaalsContact N-OD2 3.07Å; R297-D370 IonicContact NE-OD2 2.76Å; R297-D370 PolarHBondContact NE-OD2 3.33Å; R297-D370 IonicContact NH2-OD2 3.3Å; R297-D370 PolarHBondContact NH2-OD2 2.88Å; D368-D370 VanDerWaalsContact C-N 3.31Å; D368-D370 WeakPolarHBondContact OD1-CA 3.36Å; D368-D370 WeakPolarHBondContact OD1-CB 3.26Å; D368-D370 PolarHBondContact OD1-N 3.38Å
371	A	95.1	Very high	92.6	Very high	46 Å²	46	54.6 Å²	54.6	38%	0.38	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.2	-4.7	-178.9	0	0	0	0	0	114.2	D368 K373	D368-A371 HydrophobicContact CB-CB 4.01Å; D368-A371 PolarHBondContact OD1-N 3.26Å; A371-K373 HydrophobicContact CB-CD 4.35Å
372	N	94.3	Very high	92.5	Very high	65 Å²	65	58.5 Å²	58.5	35%	0.348	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	47	60.1	-169.4	-174.8	-7.1	0	0	0	112.3	L274 T278 D368	L274-N372 WeakPolarHBondContact CA-OD1 3.22Å; L274-N372 PolarHBondContact O-ND2 3.38Å; L274-N372 PolarHBondContact O-OD1 3.3Å; T278-N372 VanDerWaalsContact CB-OD1 3.31Å; T278-N372 WeakPolarHBondContact CB-OD1 3.37Å; T278-N372 PolarHBondContact OG1-OD1 3.1Å; D368-N372 WeakPolarHBondContact O-CA 3.37Å; D368-N372 PolarHBondContact O-N 3.26Å; D368-N372 VanDerWaalsContact O-N 3.1Å
373	K	94.3	Very high	92.5	Very high	123 Å²	123	58 Å²	58	54%	0.535	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	134.5	-178	-74	173.7	-169.4	170.2	0	112.6	V367 D368 A371	V367-K373 CarbonylContact C-O 3.57Å; V367-K373 WeakPolarHBondContact CA-O 3.46Å; D368-K373 PolarHBondContact N-O 2.76Å; D368-K373 PolarHBondContact O-N 2.72Å; D368-K373 VanDerWaalsContact O-N 3.14Å; A371-K373 HydrophobicContact CB-CD 4.35Å
374	M	94.7	Very high	92.5	Very high	40 Å²	40	55.4 Å²	55.4	20%	0.197	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	125.3	164.5	-173.6	173.4	-159.6	0	0	108.9	T278 K281 V282 A285 W365 V367 I383	T278-M374 HydrophobicContact CG2-CB 4.33Å; K281-M374 HydrophobicContact CB-SD 4.17Å; V282-M374 HydrophobicContact CG2-CE 4.26Å; V282-M374 HydrophobicContact CG2-CG 4.43Å; V282-M374 HydrophobicContact CG2-SD 3.81Å; A285-M374 HydrophobicContact CB-CE 3.74Å; W365-M374 HydrophobicContact CB-CE 3.73Å; W365-M374 HydrophobicContact CD2-CE 3.79Å; W365-M374 HydrophobicContact CE3-CE 3.98Å; W365-M374 HydrophobicContact CE3-CG 3.96Å; W365-M374 HydrophobicContact CE3-SD 4.44Å; W365-M374 HydrophobicContact CG-CE 3.69Å; V367-M374 HydrophobicContact CG2-CE 4.45Å; V367-M374 HydrophobicContact CG2-CG 4.13Å; M374-I383 HydrophobicContact CE-CD1 3.47Å; M374-I383 VanDerWaalsContact CE-CD1 3.47Å; M374-I383 HydrophobicContact SD-CD1 3.84Å
375	M	94	Very high	92.3	Very high	82 Å²	82	62.2 Å²	62.2	40%	0.404	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	145.2	-176.5	-63.2	178.4	-74.1	0	0	109.8	L366 D368	L366-M375 HydrophobicContact CD2-CE 3.96Å; L366-M375 HydrophobicContact CG-CE 4.15Å; L366-M375 PolarHBondContact N-O 2.84Å; L366-M375 PolarHBondContact O-N 3.37Å; D368-M375 HydrophobicContact CB-CE 4.2Å
376	G	88.6	Confident	92.2	Very high	41 Å²	41	61.7 Å²	61.7	42%	0.423	35%	0.351	S	S	.	.			trans	-153.6	161.2	177.7	0	0	0	0	0	111.1
377	S	87.8	Confident	92	Very high	40 Å²	40	60.8 Å²	60.8	28%	0.28	35%	0.346	S	S	.	.			trans	-63.1	151.1	170.8	-174.6	0	0	0	0	111.2	A362 L379 L380	A362-S377 WeakPolarHBondContact O-CB 3.32Å; S377-L379 PolarHBondContact O-N 3.03Å; S377-L379 VanDerWaalsContact O-N 3.11Å; S377-L379 PolarHBondContact OG-N 3.28Å; S377-L380 WeakPolarHBondContact O-CB 3.19Å; S377-L380 PolarHBondContact O-N 2.95Å; S377-L380 VanDerWaalsContact O-N 3.11Å
378	S	83.1	Confident	91.7	Very high	125 Å²	125	67.8 Å²	67.8	87%	0.874	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.4	-8	169	54.6	0	0	0	0	114
379	L	84.2	Confident	91.5	Very high	143 Å²	143	73.6 Å²	73.6	75%	0.749	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86	-13.8	174	-59.9	177.6	0	0	0	113.4	A362 S377	A362-L379 HydrophobicContact CB-CD1 4.17Å; S377-L379 PolarHBondContact O-N 3.03Å; S377-L379 VanDerWaalsContact O-N 3.11Å; S377-L379 PolarHBondContact OG-N 3.28Å
380	L	86.8	Confident	91.4	Very high	25 Å²	25	74.4 Å²	74.4	13%	0.131	41%	0.407	C	S	.	.	S	Bend	trans	-72.6	140.8	177	-82.4	161.7	0	0	0	110.8	A362 W365 S377	A362-L380 WeakPolarHBondContact O-CG 3.43Å; W365-L380 HydrophobicContact CD2-CD1 3.88Å; W365-L380 HydrophobicContact CE3-CD1 4.33Å; W365-L380 HydrophobicContact CG-CD1 4.22Å; W365-L380 HydrophobicContact CH2-CB 4.33Å; W365-L380 HydrophobicContact CH2-CD1 4.48Å; W365-L380 HydrophobicContact CZ2-CB 3.83Å; W365-L380 HydrophobicContact CZ2-CD1 4.05Å; W365-L380 HydrophobicContact CZ2-CG 4.4Å; S377-L380 WeakPolarHBondContact O-CB 3.19Å; S377-L380 PolarHBondContact O-N 2.95Å; S377-L380 VanDerWaalsContact O-N 3.11Å
381	E	86.6	Confident	91.3	Very high	122 Å²	122	72.7 Å²	72.7	57%	0.57	40%	0.4	S	S	*	.	P	Polyproline II helix	trans	-67.4	132.4	169.5	-161.1	-169.9	161.7	0	0	109.2	I383 K488	E381-I383 PolarHBondContact O-N 3.46Å; E381-K488 IonicContact OE1-NZ 3.36Å; E381-K488 PolarHBondContact OE1-NZ 3.45Å; E381-K488 IonicContact OE2-NZ 3.65Å; E381-K488 PolarHBondContact OE2-NZ 3.35Å
382	P	89.4	Confident	91.3	Very high	102 Å²	102	75.2 Å²	75.2	66%	0.662	40%	0.404	S	S	*	.	P	Polyproline II helix	trans	-61.2	135.8	179	24.1	-34.7	0	0	0	111.4
383	I	93.3	Very high	91.3	Very high	37 Å²	37	76.6 Å²	76.6	19%	0.19	41%	0.41	C	S	.	.	P	Polyproline II helix	trans	-62	123.1	176.3	-61.8	155.3	0	0	0	108.3	T284 A285 W365 M374 E381	T284-I383 HydrophobicContact CG2-CG2 3.54Å; A285-I383 HydrophobicContact CB-CD1 3.83Å; A285-I383 HydrophobicContact CB-CG1 4.26Å; W365-I383 HydrophobicContact CD2-CD1 4.14Å; W365-I383 HydrophobicContact CE3-CD1 4.46Å; W365-I383 HydrophobicContact CH2-CD1 4.21Å; W365-I383 HydrophobicContact CZ2-CD1 3.83Å; W365-I383 HydrophobicContact CZ2-CG1 3.85Å; M374-I383 HydrophobicContact CE-CD1 3.47Å; M374-I383 VanDerWaalsContact CE-CD1 3.47Å; M374-I383 HydrophobicContact SD-CD1 3.84Å; E381-I383 PolarHBondContact O-N 3.46Å
384	P	93.9	Very high	91.4	Very high	20 Å²	20	70.9 Å²	70.9	13%	0.13	39%	0.385	C	S	.	.	P	Polyproline II helix	trans	-68.9	143.2	179.3	30.2	-35.7	0	0	0	110.3	L288 P484 F485 K488	L288-P384 HydrophobicContact CD1-CG 3.45Å; L288-P384 VanDerWaalsContact CD1-CG 3.45Å; P384-P484 HydrophobicContact CB-CB 4.12Å; P384-F485 HydrophobicContact CB-CB 4.25Å; P384-F485 HydrophobicContact CG-CB 4.16Å; P384-K488 HydrophobicContact CG-CD 4.44Å
385	L	91.8	Very high	91.4	Very high	144 Å²	144	70.5 Å²	70.5	75%	0.754	39%	0.386	S	S	*	.	P	Polyproline II helix	trans	-66.1	147	176.2	-61.8	174.2	0	0	0	111.3	F485	L385-F485 WeakPolarHBondContact O-CB 3.37Å
386	L	93.7	Very high	91.5	Very high	21 Å²	21	72.8 Å²	72.8	11%	0.11	40%	0.396	C	S	.	.	P	Polyproline II helix	trans	-60.6	155.3	170.3	-62.1	-178.1	0	0	0	110.9	T284 E388 L394 F443 F485	T284-L386 HydrophobicContact CG2-CD2 3.99Å; T284-L386 WeakPolarHBondContact OG1-CD2 3.32Å; L386-E388 PolarHBondContact O-N 3.33Å; L386-L394 HydrophobicContact CD1-CD2 4.49Å; L386-F443 HydrophobicContact CD1-CZ 4.48Å; L386-F443 HydrophobicContact CD2-CZ 4.03Å; L386-F485 HydrophobicContact CD2-CD1 4.35Å; L386-F485 HydrophobicContact CD2-CD2 3.75Å; L386-F485 HydrophobicContact CD2-CE1 4.03Å; L386-F485 HydrophobicContact CD2-CE2 3.41Å; L386-F485 VanDerWaalsContact CD2-CE2 3.41Å; L386-F485 HydrophobicContact CD2-CG 4.2Å; L386-F485 HydrophobicContact CD2-CZ 3.53Å
387	P	93.2	Very high	91.7	Very high	3 Å²	3	72.5 Å²	72.5	2%	0.019	38%	0.384	C	S	.	.	P	Polyproline II helix	trans	-58.2	128.2	174.6	-21.6	33.8	0	0	0	110.7	K389 E390 S391 V449 T483 F485	P387-K389 PolarHBondContact O-N 3.25Å; P387-E390 HydrophobicContact CB-CB 4.21Å; P387-E390 HydrophobicContact CB-CG 4.39Å; P387-E390 VanDerWaalsContact CB-OE2 3.28Å; P387-E390 WeakPolarHBondContact CB-OE2 3.3Å; P387-E390 PolarHBondContact O-N 3Å; P387-S391 VanDerWaalsContact O-CB 3.22Å; P387-S391 WeakPolarHBondContact O-CB 3.42Å; P387-S391 PolarHBondContact O-N 3.07Å; P387-V449 HydrophobicContact CG-CG2 4.1Å; P387-T483 HydrophobicContact CB-CG2 3.9Å; P387-T483 HydrophobicContact CG-CG2 3.91Å; P387-F485 HydrophobicContact CG-CD1 4.02Å; P387-F485 HydrophobicContact CG-CE1 4.45Å
388	E	90.8	Very high	92	Very high	147 Å²	147	70.7 Å²	70.7	69%	0.687	37%	0.372	S	S	*	.	H	α-helix	trans	-58.7	-44.9	-162.1	-174	178.7	-175	0	0	113.9	L386 Q392	L386-E388 PolarHBondContact O-N 3.33Å; E388-Q392 VanDerWaalsContact O-CG 3.27Å; E388-Q392 WeakPolarHBondContact O-CG 3.25Å; E388-Q392 PolarHBondContact O-N 2.93Å
389	K	92.9	Very high	92.4	Very high	150 Å²	150	68.5 Å²	68.5	65%	0.652	35%	0.35	S	S	*	.	H	α-helix	trans	-69.9	-46.8	-179.2	-62	-179.6	179.3	178.7	0	111.5	P387 S391 Q392 I393	P387-K389 PolarHBondContact O-N 3.25Å; K389-S391 VanDerWaalsContact C-N 3.28Å; K389-S391 PolarHBondContact O-N 3.19Å; K389-Q392 PolarHBondContact O-N 2.86Å; K389-I393 VanDerWaalsContact O-CG1 3.3Å; K389-I393 WeakPolarHBondContact O-CG1 3.46Å; K389-I393 PolarHBondContact O-N 3.03Å
390	E	94.8	Very high	92.7	Very high	23 Å²	23	68.3 Å²	68.3	11%	0.107	35%	0.345	C	S	.	.	H	α-helix	trans	-64.7	-35.3	179.4	-66.1	72.2	-171.7	0	0	111.1	P387 L394 F443 S446 N448 V449	P387-E390 HydrophobicContact CB-CB 4.21Å; P387-E390 HydrophobicContact CB-CG 4.39Å; P387-E390 VanDerWaalsContact CB-OE2 3.28Å; P387-E390 WeakPolarHBondContact CB-OE2 3.3Å; P387-E390 PolarHBondContact O-N 3Å; E390-L394 WeakPolarHBondContact O-CB 3.2Å; E390-L394 PolarHBondContact O-N 3.21Å; E390-F443 HydrophobicContact CB-CD2 4.03Å; E390-F443 HydrophobicContact CB-CE2 3.95Å; E390-S446 WeakPolarHBondContact CG-OG 3.32Å; E390-N448 WeakPolarHBondContact OE1-CB 3.37Å; E390-N448 PolarHBondContact OE1-ND2 2.86Å; E390-V449 HydrophobicContact CB-CG2 4.45Å; E390-V449 HydrophobicContact CG-CG2 4.36Å
391	S	93.6	Very high	92.7	Very high	27 Å²	27	67.3 Å²	67.3	19%	0.189	34%	0.341	C	S	.	.	H	α-helix	trans	-68.7	-42.2	173.9	-167.9	0	0	0	0	112.2	P387 K389 L394 C395	P387-S391 VanDerWaalsContact O-CB 3.22Å; P387-S391 WeakPolarHBondContact O-CB 3.42Å; P387-S391 PolarHBondContact O-N 3.07Å; K389-S391 VanDerWaalsContact C-N 3.28Å; K389-S391 PolarHBondContact O-N 3.19Å; S391-L394 PolarHBondContact O-N 3.43Å; S391-C395 PolarHBondContact O-N 2.87Å; S391-C395 PolarHBondContact O-SG 3.39Å
392	Q	95.1	Very high	92.7	Very high	100 Å²	100	63.4 Å²	63.4	47%	0.467	32%	0.324	S	S	.	.	H	α-helix	trans	-60.9	-48.7	175	-75.3	165.4	7.1	0	0	110.6	E388 K389 L394 C395 E396	E388-Q392 VanDerWaalsContact O-CG 3.27Å; E388-Q392 WeakPolarHBondContact O-CG 3.25Å; E388-Q392 PolarHBondContact O-N 2.93Å; K389-Q392 PolarHBondContact O-N 2.86Å; Q392-L394 VanDerWaalsContact C-N 3.31Å; Q392-L394 PolarHBondContact O-N 2.93Å; Q392-C395 PolarHBondContact O-N 3.48Å; Q392-E396 WeakPolarHBondContact O-CG 3.39Å; Q392-E396 PolarHBondContact O-N 3.38Å
393	I	95.8	Very high	92.5	Very high	93 Å²	93	61.8 Å²	61.8	48%	0.477	32%	0.315	S	S	.	.	H	α-helix	trans	-59.8	-41.6	176	-66.3	164.9	0	0	0	110.8	K389 N397	K389-I393 VanDerWaalsContact O-CG1 3.3Å; K389-I393 WeakPolarHBondContact O-CG1 3.46Å; K389-I393 PolarHBondContact O-N 3.03Å; I393-N397 WeakPolarHBondContact CG2-ND2 3.49Å; I393-N397 PolarHBondContact O-N 2.95Å; I393-N397 PolarHBondContact O-ND2 2.98Å
394	L	95.8	Very high	91.7	Very high	4 Å²	4	62.5 Å²	62.5	2%	0.021	32%	0.323	C	S	.	.	H	α-helix	trans	-63.1	-49	176.8	179.9	59.6	0	0	0	111.5	L280 L386 E390 S391 Q392 E396 N397 L398 A439 M440 F443	L280-L394 HydrophobicContact CD2-CD2 3.74Å; L280-L394 HydrophobicContact CD2-CG 4.36Å; L386-L394 HydrophobicContact CD1-CD2 4.49Å; E390-L394 WeakPolarHBondContact O-CB 3.2Å; E390-L394 PolarHBondContact O-N 3.21Å; S391-L394 PolarHBondContact O-N 3.43Å; Q392-L394 VanDerWaalsContact C-N 3.31Å; Q392-L394 PolarHBondContact O-N 2.93Å; L394-E396 PolarHBondContact O-N 3.45Å; L394-N397 PolarHBondContact O-N 3.28Å; L394-L398 HydrophobicContact CD1-CD1 3.83Å; L394-L398 HydrophobicContact CD1-CD2 4.49Å; L394-L398 HydrophobicContact CD1-CG 3.95Å; L394-L398 HydrophobicContact CG-CD1 3.88Å; L394-L398 HydrophobicContact CG-CG 4.37Å; L394-L398 VanDerWaalsContact O-CG 3.3Å; L394-L398 WeakPolarHBondContact O-CG 3.13Å; L394-L398 PolarHBondContact O-N 3.47Å; L394-A439 HydrophobicContact CD1-CB 4.19Å; L394-M440 HydrophobicContact CD1-SD 3.88Å; L394-M440 HydrophobicContact CD2-SD 4.14Å; L394-F443 HydrophobicContact CB-CD2 4.19Å; L394-F443 HydrophobicContact CD1-CB 4.15Å; L394-F443 HydrophobicContact CD2-CB 4.33Å; L394-F443 HydrophobicContact CD2-CD1 4.42Å; L394-F443 HydrophobicContact CD2-CD2 3.95Å; L394-F443 HydrophobicContact CD2-CE2 4.41Å; L394-F443 HydrophobicContact CD2-CG 3.97Å
395	C	95.2	Very high	90.8	Very high	31 Å²	31	63.6 Å²	63.6	21%	0.209	33%	0.327	C	S	.	.	H	α-helix	trans	-55.3	-50.2	175.5	-67.2	0	0	0	0	111.4	M276 L280 S391 Q392 N397 L398 D399	M276-C395 HydrophobicContact CG-CB 4.31Å; L280-C395 WeakPolarHBondContact CD1-SG 3.18Å; S391-C395 PolarHBondContact O-N 2.87Å; S391-C395 PolarHBondContact O-SG 3.39Å; Q392-C395 PolarHBondContact O-N 3.48Å; C395-N397 PolarHBondContact O-N 2.95Å; C395-L398 PolarHBondContact O-N 2.88Å; C395-D399 WeakPolarHBondContact O-CB 3.46Å; C395-D399 PolarHBondContact O-N 3.38Å
396	E	94.8	Very high	89.7	Confident	130 Å²	130	60.9 Å²	60.9	61%	0.607	32%	0.316	S	S	*	.	H	α-helix	trans	-57.2	-44.6	179.2	-73.2	172.6	-176.5	0	0	112.6	Q392 L394 Q400	Q392-E396 WeakPolarHBondContact O-CG 3.39Å; Q392-E396 PolarHBondContact O-N 3.38Å; L394-E396 PolarHBondContact O-N 3.45Å; E396-Q400 VanDerWaalsContact O-CB 3.29Å; E396-Q400 WeakPolarHBondContact O-CB 3.38Å; E396-Q400 PolarHBondContact O-N 2.95Å
397	N	93.9	Very high	88.1	Confident	35 Å²	35	63.4 Å²	63.4	19%	0.187	34%	0.34	C	S	.	.	H	α-helix	trans	-67.9	-37.7	178	-75.9	-79.7	0	0	0	112.2	I393 L394 C395 A401 A439	I393-N397 WeakPolarHBondContact CG2-ND2 3.49Å; I393-N397 PolarHBondContact O-N 2.95Å; I393-N397 PolarHBondContact O-ND2 2.98Å; L394-N397 PolarHBondContact O-N 3.28Å; C395-N397 PolarHBondContact O-N 2.95Å; N397-A401 PolarHBondContact O-N 2.96Å; N397-A439 HydrophobicContact CB-CB 3.72Å
398	L	93.4	Very high	86.1	Confident	3 Å²	3	68.5 Å²	68.5	2%	0.016	37%	0.368	C	S	.	.	H	α-helix	trans	-72.6	-42.9	178.4	-67	176.4	0	0	0	111.6	L271 M276 L280 L394 C395 Q400 A401 L402 T436 A439	L271-L398 HydrophobicContact CD1-CD2 4.4Å; L271-L398 HydrophobicContact CD2-CD1 4.37Å; M276-L398 HydrophobicContact CE-CB 3.44Å; M276-L398 VanDerWaalsContact CE-CB 3.44Å; M276-L398 HydrophobicContact CE-CD1 4.47Å; M276-L398 HydrophobicContact SD-CB 3.82Å; M276-L398 HydrophobicContact SD-CD1 3.74Å; M276-L398 HydrophobicContact SD-CG 4.45Å; L280-L398 HydrophobicContact CD2-CD1 4.14Å; L394-L398 HydrophobicContact CD1-CD1 3.83Å; L394-L398 HydrophobicContact CD1-CD2 4.49Å; L394-L398 HydrophobicContact CD1-CG 3.95Å; L394-L398 HydrophobicContact CG-CD1 3.88Å; L394-L398 HydrophobicContact CG-CG 4.37Å; L394-L398 VanDerWaalsContact O-CG 3.3Å; L394-L398 WeakPolarHBondContact O-CG 3.13Å; L394-L398 PolarHBondContact O-N 3.47Å; C395-L398 PolarHBondContact O-N 2.88Å; L398-Q400 VanDerWaalsContact C-N 3.29Å; L398-Q400 PolarHBondContact O-N 3.49Å; L398-A401 WeakPolarHBondContact O-CB 3.46Å; L398-A401 PolarHBondContact O-N 3.49Å; L398-A401 VanDerWaalsContact O-N 3.16Å; L398-L402 VanDerWaalsContact O-CG 3.31Å; L398-L402 WeakPolarHBondContact O-CG 3.33Å; L398-L402 PolarHBondContact O-N 3.49Å; L398-T436 HydrophobicContact CD2-CG2 3.8Å; L398-A439 HydrophobicContact CD2-CB 4.13Å
399	D	91.7	Very high	84.2	Confident	78 Å²	78	67.4 Å²	67.4	42%	0.417	37%	0.366	S	S	.	.	H	α-helix	trans	-60.7	-38.8	173.4	-76.7	-33.6	0	0	0	111.1	M276 C395 S403	M276-D399 HydrophobicContact CE-CB 4.49Å; M276-D399 WeakPolarHBondContact CE-OD1 3.47Å; C395-D399 WeakPolarHBondContact O-CB 3.46Å; C395-D399 PolarHBondContact O-N 3.38Å; D399-S403 WeakPolarHBondContact O-CB 3.13Å; D399-S403 PolarHBondContact O-N 2.8Å; D399-S403 PolarHBondContact O-OG 3.09Å
400	Q	89.9	Confident	82	Confident	139 Å²	139	65.7 Å²	65.7	65%	0.65	37%	0.368	S	S	*	.	H	α-helix	trans	-64.1	-43	173.4	-174	178.9	9.7	0	0	112	E396 L398 S403 S404	E396-Q400 VanDerWaalsContact O-CB 3.29Å; E396-Q400 WeakPolarHBondContact O-CB 3.38Å; E396-Q400 PolarHBondContact O-N 2.95Å; L398-Q400 VanDerWaalsContact C-N 3.29Å; L398-Q400 PolarHBondContact O-N 3.49Å; Q400-S403 PolarHBondContact O-N 3.3Å; Q400-S404 PolarHBondContact O-N 3.47Å; Q400-S404 VanDerWaalsContact O-N 3.13Å
401	A	87.7	Confident	79.5	Confident	5 Å²	5	70.5 Å²	70.5	4%	0.041	40%	0.401	C	S	.	.	H	α-helix	trans	-61.2	-48.2	176.5	0	0	0	0	0	111.4	N397 L398 S404 A432 A435	N397-A401 PolarHBondContact O-N 2.96Å; L398-A401 WeakPolarHBondContact O-CB 3.46Å; L398-A401 PolarHBondContact O-N 3.49Å; L398-A401 VanDerWaalsContact O-N 3.16Å; A401-S404 PolarHBondContact O-N 3.18Å; A401-S404 PolarHBondContact O-OG 2.73Å; A401-A432 WeakPolarHBondContact O-CB 3.45Å; A401-A435 HydrophobicContact CB-CB 3.85Å
402	L	86.5	Confident	76.6	Confident	40 Å²	40	76 Å²	76	21%	0.209	43%	0.429	C	S	.	.	H	α-helix	trans	-64	-41.1	177.4	-65.3	169.5	0	0	0	112.5	H268 L271 M276 L398 S404 M405 T406	H268-L402 HydrophobicContact CB-CD2 3.71Å; L271-L402 HydrophobicContact CB-CD1 3.98Å; L271-L402 HydrophobicContact CB-CD2 4.25Å; L271-L402 HydrophobicContact CD1-CD1 4.25Å; L271-L402 HydrophobicContact CD1-CD2 4.29Å; L271-L402 HydrophobicContact CD1-CG 4.49Å; M276-L402 HydrophobicContact CE-CD1 3.89Å; L398-L402 VanDerWaalsContact O-CG 3.31Å; L398-L402 WeakPolarHBondContact O-CG 3.33Å; L398-L402 PolarHBondContact O-N 3.49Å; L402-S404 VanDerWaalsContact C-N 3.27Å; L402-S404 PolarHBondContact O-N 2.74Å; L402-M405 WeakPolarHBondContact O-CB 3.49Å; L402-M405 PolarHBondContact O-N 2.86Å; L402-M405 VanDerWaalsContact O-N 3.14Å; L402-T406 PolarHBondContact O-N 3.4Å
403	S	85.1	Confident	73.8	Confident	67 Å²	67	79.9 Å²	79.9	47%	0.469	45%	0.447	S	S	.	.	H	α-helix	trans	-63.8	-32.8	178.8	-61.5	0	0	0	0	112.5	D399 Q400 M405 T406 A407	D399-S403 WeakPolarHBondContact O-CB 3.13Å; D399-S403 PolarHBondContact O-N 2.8Å; D399-S403 PolarHBondContact O-OG 3.09Å; Q400-S403 PolarHBondContact O-N 3.3Å; S403-M405 PolarHBondContact O-N 3.18Å; S403-T406 PolarHBondContact O-N 3.32Å; S403-T406 PolarHBondContact O-OG1 2.93Å; S403-A407 WeakPolarHBondContact O-CB 3.46Å; S403-A407 PolarHBondContact O-N 2.92Å; S403-A407 VanDerWaalsContact O-N 3.13Å
404	S	76.7	Confident	70.9	Confident	52 Å²	52	80.2 Å²	80.2	36%	0.364	46%	0.457	S	S	.	.	H	α-helix	trans	-63.7	-24.3	176.7	78.4	0	0	0	0	113.4	Q400 A401 L402	Q400-S404 PolarHBondContact O-N 3.47Å; Q400-S404 VanDerWaalsContact O-N 3.13Å; A401-S404 PolarHBondContact O-N 3.18Å; A401-S404 PolarHBondContact O-OG 2.73Å; L402-S404 VanDerWaalsContact C-N 3.27Å; L402-S404 PolarHBondContact O-N 2.74Å
405	M	75.4	Confident	67.9	Low	43 Å²	43	86.3 Å²	86.3	21%	0.212	50%	0.495	C	S	.	.	H	α-helix	trans	-83.3	-34.8	178.2	-172.4	170.6	169.4	0	0	112.7	H268 L402 S403 A429	H268-M405 WeakPolarHBondContact NE2-CE 3.49Å; L402-M405 WeakPolarHBondContact O-CB 3.49Å; L402-M405 PolarHBondContact O-N 2.86Å; L402-M405 VanDerWaalsContact O-N 3.14Å; S403-M405 PolarHBondContact O-N 3.18Å; M405-A429 HydrophobicContact CE-CB 3.62Å; M405-A429 HydrophobicContact SD-CB 3.79Å
406	T	68.1	Low	65	Low	87 Å²	87	94 Å²	94	53%	0.534	53%	0.527	S	S	.	.	H	α-helix	trans	-87.9	-23.7	-176.6	46.5	0	0	0	0	114.4	L402 S403 N408 L409	L402-T406 PolarHBondContact O-N 3.4Å; S403-T406 PolarHBondContact O-N 3.32Å; S403-T406 PolarHBondContact O-OG1 2.93Å; T406-N408 PolarHBondContact O-N 2.9Å; T406-L409 PolarHBondContact O-N 2.95Å
407	A	59	Low	62.5	Low	74 Å²	74	92 Å²	92	61%	0.612	52%	0.52	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.7	-13.2	-173.6	0	0	0	0	0	116.2	S403	S403-A407 WeakPolarHBondContact O-CB 3.46Å; S403-A407 PolarHBondContact O-N 2.92Å; S403-A407 VanDerWaalsContact O-N 3.13Å
408	N	52.1	Low	60.2	Low	111 Å²	111	97.1 Å²	97.1	59%	0.594	55%	0.548	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.1	9.9	-178.5	-68.1	-46.4	0	0	0	114.4	T406 T410 N428	T406-N408 PolarHBondContact O-N 2.9Å; N408-T410 PolarHBondContact O-N 3.27Å; N408-N428 PolarHBondContact ND2-ND2 3.46Å; N408-N428 VanDerWaalsContact ND2-ND2 3.15Å
409	L	50.2	Low	57.8	Low	123 Å²	123	104 Å²	104	64%	0.644	58%	0.584	S	S	*	*			trans	-94.6	62.2	175.8	-68.8	171.2	0	0	0	112.2	T406	T406-L409 PolarHBondContact O-N 2.95Å
410	T	46.6	Very low	55.4	Low	114 Å²	114	107.8 Å²	107.8	70%	0.699	60%	0.597	S	S	*	*			trans	-82.1	129	167.1	47.6	0	0	0	0	110.5	N408 D412	N408-T410 PolarHBondContact O-N 3.27Å; T410-D412 VanDerWaalsContact C-N 3.26Å; T410-D412 PolarHBondContact O-N 3Å
411	P	42.6	Very low	53.4	Low	124 Å²	124	105.4 Å²	105.4	81%	0.805	59%	0.588	S	S	*	*			trans	-75.8	-1.5	-171.2	-17.1	32.2	0	0	0	116.6
412	D	33.7	Very low	51.8	Low	143 Å²	143	108.5 Å²	108.5	77%	0.765	61%	0.61	S	S	*	*			trans	-107.7	88.6	-170.5	-69.2	-41.4	0	0	0	111.8	T410	T410-D412 VanDerWaalsContact C-N 3.26Å; T410-D412 PolarHBondContact O-N 3Å
413	E	36.5	Very low	50.5	Low	181 Å²	181	109.6 Å²	109.6	85%	0.846	62%	0.624	S	S	*	*			trans	-169.6	144.4	130.2	-106.8	175.4	-161.3	0	0	112
414	S	34	Very low	49.3	Very low	101 Å²	101	110.9 Å²	110.9	71%	0.706	63%	0.626	S	S	*	*			trans	-80.1	129.8	-166.6	53.2	0	0	0	0	114.5	E416	S414-E416 PolarHBondContact O-N 3.36Å
415	T	32.8	Very low	48.6	Very low	131 Å²	131	112.8 Å²	112.8	80%	0.804	63%	0.629	S	S	*	*	S	Bend	trans	38.9	75.9	144.2	58	0	0	0	0	118
416	E	34.8	Very low	48.1	Very low	192 Å²	192	116 Å²	116	90%	0.897	65%	0.647	S	S	*	*	S	Bend	trans	-173.2	-6	141.8	-109.3	171.5	-160.8	0	0	114.8	S414 N418	S414-E416 PolarHBondContact O-N 3.36Å; E416-N418 PolarHBondContact O-N 3.22Å
417	I	41.6	Very low	48.2	Very low	88 Å²	88	117.7 Å²	117.7	45%	0.451	64%	0.643	S	S	.	*			trans	-102.3	49.4	-167.5	-38	180	0	0	0	114.4	K420 N421	I417-K420 HydrophobicContact CG2-CB 4.13Å; I417-N421 WeakPolarHBondContact CG2-OD1 3.29Å; I417-N421 WeakPolarHBondContact O-CB 3.48Å; I417-N421 VanDerWaalsContact O-CG 3.23Å; I417-N421 PolarHBondContact O-ND2 3.15Å
418	N	45.5	Very low	49.2	Very low	143 Å²	143	116.2 Å²	116.2	77%	0.765	63%	0.625	S	S	*	*	H	α-helix	trans	-80.3	-31.3	-175.9	-99.8	-12.6	0	0	0	115.8	E416	E416-N418 PolarHBondContact O-N 3.22Å
419	L	43	Very low	50.8	Low	148 Å²	148	111.4 Å²	111.4	78%	0.775	60%	0.601	S	S	*	*	H	α-helix	trans	-80.2	-46.3	-179.3	-87.3	80.2	0	0	0	113.5	N421 S422 A423	L419-N421 VanDerWaalsContact C-N 3.32Å; L419-N421 PolarHBondContact O-N 3.31Å; L419-S422 PolarHBondContact O-N 2.92Å; L419-A423 PolarHBondContact O-N 2.8Å
420	K	42.9	Very low	52.7	Low	158 Å²	158	106.7 Å²	106.7	69%	0.687	58%	0.576	S	S	*	*	H	α-helix	trans	-65.7	-34.5	-176.7	-72.4	-174.8	177.7	179	0	112.9	I417 N424	I417-K420 HydrophobicContact CG2-CB 4.13Å; K420-N424 PolarHBondContact O-N 3.2Å
421	N	47.4	Very low	54.8	Low	89 Å²	89	103.4 Å²	103.4	48%	0.476	56%	0.558	S	S	.	*	H	α-helix	trans	-67.4	-38.8	179.2	-70.9	-0.7	0	0	0	111.6	I417 L419 N424 Q425	I417-N421 WeakPolarHBondContact CG2-OD1 3.29Å; I417-N421 WeakPolarHBondContact O-CB 3.48Å; I417-N421 VanDerWaalsContact O-CG 3.23Å; I417-N421 PolarHBondContact O-ND2 3.15Å; L419-N421 VanDerWaalsContact C-N 3.32Å; L419-N421 PolarHBondContact O-N 3.31Å; N421-N424 PolarHBondContact O-N 3.49Å; N421-Q425 VanDerWaalsContact O-CB 3.32Å; N421-Q425 WeakPolarHBondContact O-CB 3.44Å; N421-Q425 PolarHBondContact O-N 2.97Å
422	S	53.6	Low	57.1	Low	70 Å²	70	97.5 Å²	97.5	49%	0.49	52%	0.52	S	S	.	.	H	α-helix	trans	-65.3	-43.5	178.3	-168.3	0	0	0	0	112.5	L419 Q425 L426	L419-S422 PolarHBondContact O-N 2.92Å; S422-Q425 PolarHBondContact O-N 3.29Å; S422-L426 PolarHBondContact O-N 2.84Å
423	A	58.1	Low	59.8	Low	63 Å²	63	90.9 Å²	90.9	52%	0.521	48%	0.484	S	S	.	.	H	α-helix	trans	-63.8	-41.7	176.8	0	0	0	0	0	112.8	L419 L426 R427	L419-A423 PolarHBondContact O-N 2.8Å; A423-L426 PolarHBondContact O-N 2.64Å; A423-R427 PolarHBondContact O-N 3.27Å; A423-R427 VanDerWaalsContact O-N 3.08Å
424	N	61.5	Low	62.6	Low	94 Å²	94	82.3 Å²	82.3	50%	0.503	44%	0.444	S	S	.	.	H	α-helix	trans	-65.3	-40.2	175	-75.3	-17.4	0	0	0	111.9	K420 N421 R427 N428	K420-N424 PolarHBondContact O-N 3.2Å; N421-N424 PolarHBondContact O-N 3.49Å; N424-R427 PolarHBondContact O-N 2.91Å; N424-N428 PolarHBondContact O-N 3.1Å; N424-N428 VanDerWaalsContact O-N 3.07Å; N424-N428 PolarHBondContact O-ND2 3.45Å; N424-N428 PolarHBondContact O-OD1 3.38Å
425	Q	61.4	Low	65.4	Low	91 Å²	91	79.4 Å²	79.4	43%	0.425	43%	0.426	S	S	.	.	H	α-helix	trans	-64	-40.8	177.4	-169.6	174.5	14.6	0	0	111.9	N421 S422 N428 A429	N421-Q425 VanDerWaalsContact O-CB 3.32Å; N421-Q425 WeakPolarHBondContact O-CB 3.44Å; N421-Q425 PolarHBondContact O-N 2.97Å; S422-Q425 PolarHBondContact O-N 3.29Å; Q425-N428 PolarHBondContact O-N 3Å; Q425-A429 PolarHBondContact O-N 3.3Å; Q425-A429 VanDerWaalsContact O-N 3.1Å
426	L	64.5	Low	68.3	Low	112 Å²	112	73.2 Å²	73.2	59%	0.586	39%	0.388	S	S	*	.	H	α-helix	trans	-63	-45.6	174.5	-133.3	75.9	0	0	0	111.8	S422 A423 N428 A429 D430	S422-L426 PolarHBondContact O-N 2.84Å; A423-L426 PolarHBondContact O-N 2.64Å; L426-N428 VanDerWaalsContact C-N 3.26Å; L426-N428 PolarHBondContact O-N 3Å; L426-A429 WeakPolarHBondContact O-CB 3.21Å; L426-A429 PolarHBondContact O-N 3.33Å; L426-A429 VanDerWaalsContact O-N 3.13Å; L426-D430 PolarHBondContact O-N 2.96Å
427	R	71	Confident	71.2	Confident	121 Å²	121	64.1 Å²	64.1	46%	0.457	35%	0.346	S	S	.	.	H	α-helix	trans	-60.2	-35.5	177.3	-170.6	178.1	-175.9	-143.7	1.4	112.4	A423 N424 S431 E521 I528	A423-R427 PolarHBondContact O-N 3.27Å; A423-R427 VanDerWaalsContact O-N 3.08Å; N424-R427 PolarHBondContact O-N 2.91Å; R427-S431 WeakPolarHBondContact O-CB 3.45Å; R427-S431 PolarHBondContact O-N 3Å; R427-E521 IonicContact NH2-OE1 2.7Å; R427-E521 PolarHBondContact NH2-OE1 3.33Å; R427-I528 HydrophobicContact CB-CD1 4.49Å; R427-I528 HydrophobicContact CG-CD1 4.14Å
428	N	78.8	Confident	73.8	Confident	43 Å²	43	60.2 Å²	60.2	23%	0.23	33%	0.326	C	S	.	.	H	α-helix	trans	-69.3	-41.6	175.5	-64.5	-21.2	0	0	0	111.7	N408 N424 Q425 L426 S431 A432	N408-N428 PolarHBondContact ND2-ND2 3.46Å; N408-N428 VanDerWaalsContact ND2-ND2 3.15Å; N424-N428 PolarHBondContact O-N 3.1Å; N424-N428 VanDerWaalsContact O-N 3.07Å; N424-N428 PolarHBondContact O-ND2 3.45Å; N424-N428 PolarHBondContact O-OD1 3.38Å; Q425-N428 PolarHBondContact O-N 3Å; L426-N428 VanDerWaalsContact C-N 3.26Å; L426-N428 PolarHBondContact O-N 3Å; N428-S431 PolarHBondContact O-N 2.83Å; N428-A432 PolarHBondContact O-N 2.89Å
429	A	86.2	Confident	76.1	Confident	11 Å²	11	53.6 Å²	53.6	9%	0.091	29%	0.291	C	S	.	.	H	α-helix	trans	-60.9	-48	174.7	0	0	0	0	0	111.8	M405 Q425 L426 S431 A432 D433	M405-A429 HydrophobicContact CE-CB 3.62Å; M405-A429 HydrophobicContact SD-CB 3.79Å; Q425-A429 PolarHBondContact O-N 3.3Å; Q425-A429 VanDerWaalsContact O-N 3.1Å; L426-A429 WeakPolarHBondContact O-CB 3.21Å; L426-A429 PolarHBondContact O-N 3.33Å; L426-A429 VanDerWaalsContact O-N 3.13Å; A429-S431 VanDerWaalsContact C-N 3.28Å; A429-S431 PolarHBondContact O-N 3.26Å; A429-A432 WeakPolarHBondContact O-CB 3.46Å; A429-A432 PolarHBondContact O-N 3.47Å; A429-A432 VanDerWaalsContact O-N 3.09Å; A429-D433 PolarHBondContact O-N 3.42Å
430	D	89.8	Confident	78.6	Confident	24 Å²	24	46.6 Å²	46.6	13%	0.128	25%	0.254	C	S	.	.	H	α-helix	trans	-58.2	-40.5	176.4	-72.9	-25	0	0	0	111.8	L426 D433 V434 K526 W529	L426-D430 PolarHBondContact O-N 2.96Å; D430-D433 PolarHBondContact O-N 3.4Å; D430-V434 PolarHBondContact O-N 3.09Å; D430-V434 VanDerWaalsContact O-N 3.13Å; D430-K526 HydrophobicContact CB-CG 4.04Å; D430-K526 WeakPolarHBondContact OD1-CE 3.46Å; D430-K526 IonicContact OD1-NZ 3.45Å; D430-W529 HydrophobicContact CB-CH2 3.72Å; D430-W529 HydrophobicContact CB-CZ2 3.82Å
431	S	90.6	Very high	81.2	Confident	44 Å²	44	39 Å²	39	31%	0.308	22%	0.222	S	C	.	.	H	α-helix	trans	-66.8	-38.6	175.3	-171.6	0	0	0	0	112.6	R427 N428 A429 D433 V434 A435	R427-S431 WeakPolarHBondContact O-CB 3.45Å; R427-S431 PolarHBondContact O-N 3Å; N428-S431 PolarHBondContact O-N 2.83Å; A429-S431 VanDerWaalsContact C-N 3.28Å; A429-S431 PolarHBondContact O-N 3.26Å; S431-D433 VanDerWaalsContact C-N 3.34Å; S431-V434 PolarHBondContact O-N 3.08Å; S431-A435 WeakPolarHBondContact O-CB 3.4Å; S431-A435 PolarHBondContact O-N 3.36Å
432	A	90.5	Very high	83.4	Confident	1 Å²	1	40.1 Å²	40.1	1%	0.008	22%	0.219	C	C	.	.	H	α-helix	trans	-65.8	-36.4	175.6	0	0	0	0	0	111.7	A401 N428 A429 A435 T436	A401-A432 WeakPolarHBondContact O-CB 3.45Å; N428-A432 PolarHBondContact O-N 2.89Å; A429-A432 WeakPolarHBondContact O-CB 3.46Å; A429-A432 PolarHBondContact O-N 3.47Å; A429-A432 VanDerWaalsContact O-N 3.09Å; A432-A435 PolarHBondContact O-N 3.44Å; A432-T436 WeakPolarHBondContact O-CB 3.38Å; A432-T436 PolarHBondContact O-N 3.1Å; A432-T436 PolarHBondContact O-OG1 3.08Å
433	D	92.3	Very high	85.5	Confident	3 Å²	3	37.2 Å²	37.2	2%	0.016	20%	0.198	C	C	.	.	H	α-helix	trans	-69.3	-32.5	175.8	-72.9	1.2	0	0	0	112.7	L267 H268 A429 D430 S431 R437	L267-D433 HydrophobicContact CB-CB 3.82Å; L267-D433 WeakPolarHBondContact CB-OD1 3.29Å; L267-D433 HydrophobicContact CD2-CB 4.46Å; L267-D433 WeakPolarHBondContact CD2-O 3.34Å; L267-D433 VanDerWaalsContact N-CG 3.32Å; L267-D433 PolarHBondContact N-OD1 2.96Å; L267-D433 PolarHBondContact N-OD2 3.4Å; H268-D433 IonicContact CE1-OD1 3.91Å; H268-D433 IonicContact CG-OD1 2.62Å; H268-D433 PolarHBondContact N-OD1 3.29Å; H268-D433 IonicContact ND1-OD1 2.64Å; H268-D433 PolarHBondContact ND1-OD1 3.16Å; A429-D433 PolarHBondContact O-N 3.42Å; D430-D433 PolarHBondContact O-N 3.4Å; S431-D433 VanDerWaalsContact C-N 3.34Å; D433-R437 PolarHBondContact O-N 3.27Å; D433-R437 PolarHBondContact O-NE 3Å
434	V	93.6	Very high	87.3	Confident	1 Å²	1	34.2 Å²	34.2	1%	0.006	17%	0.173	C	C	.	.	H	α-helix	trans	-69	-47.3	168.4	173.7	0	0	0	0	110.6	L260 D430 S431 T436 R437 V438 P520 I523 W529	L260-V434 HydrophobicContact CD1-CG1 4.2Å; L260-V434 HydrophobicContact CD1-CG2 4.32Å; D430-V434 PolarHBondContact O-N 3.09Å; D430-V434 VanDerWaalsContact O-N 3.13Å; S431-V434 PolarHBondContact O-N 3.08Å; V434-T436 VanDerWaalsContact C-N 3.28Å; V434-T436 PolarHBondContact O-N 3.36Å; V434-R437 PolarHBondContact O-N 3.08Å; V434-V438 HydrophobicContact CG1-CG2 4.41Å; V434-V438 WeakPolarHBondContact O-CG2 3.47Å; V434-V438 PolarHBondContact O-N 2.98Å; V434-P520 HydrophobicContact CB-CG 4.35Å; V434-P520 HydrophobicContact CG1-CB 4.4Å; V434-P520 HydrophobicContact CG1-CG 4.18Å; V434-P520 HydrophobicContact CG2-CB 4.42Å; V434-I523 HydrophobicContact CG1-CD1 4.11Å; V434-I523 HydrophobicContact CG1-CG1 4.3Å; V434-W529 HydrophobicContact CG2-CH2 3.56Å; V434-W529 HydrophobicContact CG2-CZ3 3.8Å
435	A	93.6	Very high	88.8	Confident	40 Å²	40	31.6 Å²	31.6	33%	0.331	16%	0.159	S	C	.	.	H	α-helix	trans	-59.1	-38.8	178.7	0	0	0	0	0	112.4	A401 S431 A432 V438 A439	A401-A435 HydrophobicContact CB-CB 3.85Å; S431-A435 WeakPolarHBondContact O-CB 3.4Å; S431-A435 PolarHBondContact O-N 3.36Å; A432-A435 PolarHBondContact O-N 3.44Å; A435-V438 PolarHBondContact O-N 3.46Å; A435-A439 WeakPolarHBondContact O-CB 3.33Å; A435-A439 PolarHBondContact O-N 3.09Å
436	T	94.1	Very high	90.3	Very high	1 Å²	1	28.4 Å²	28.4	1%	0.006	15%	0.146	C	C	.	.	H	α-helix	trans	-60.7	-47.5	175.3	-64.1	0	0	0	0	111.7	L267 M312 L398 A432 V434 V438 A439 M440	L267-T436 HydrophobicContact CD2-CG2 3.88Å; L267-T436 HydrophobicContact CG-CG2 4.31Å; M312-T436 HydrophobicContact CG-CG2 4.12Å; M312-T436 HydrophobicContact SD-CG2 4.2Å; L398-T436 HydrophobicContact CD2-CG2 3.8Å; A432-T436 WeakPolarHBondContact O-CB 3.38Å; A432-T436 PolarHBondContact O-N 3.1Å; A432-T436 PolarHBondContact O-OG1 3.08Å; V434-T436 VanDerWaalsContact C-N 3.28Å; V434-T436 PolarHBondContact O-N 3.36Å; T436-V438 PolarHBondContact O-N 3.16Å; T436-A439 WeakPolarHBondContact O-CB 3.33Å; T436-A439 PolarHBondContact O-N 2.93Å; T436-M440 WeakPolarHBondContact O-CG 3.14Å; T436-M440 PolarHBondContact O-N 3.45Å
437	R	94.8	Very high	91.6	Very high	2 Å²	2	27 Å²	27	1%	0.008	14%	0.139	C	C	.	.	H	α-helix	trans	-63.8	-38.9	175	-74.7	177.8	-74.1	176.6	2.6	112.2	L260 T261 L267 Y314 D433 V434 M440 V441 D525	L260-R437 HydrophobicContact CD1-CB 4.5Å; T261-R437 PolarHBondContact O-NH1 3.45Å; T261-R437 VanDerWaalsContact O-NH1 3.11Å; L267-R437 HydrophobicContact CD2-CG 3.59Å; Y314-R437 HydrophobicContact CD1-CB 4.46Å; D433-R437 PolarHBondContact O-N 3.27Å; D433-R437 PolarHBondContact O-NE 3Å; V434-R437 PolarHBondContact O-N 3.08Å; R437-M440 PolarHBondContact O-N 3.39Å; R437-V441 VanDerWaalsContact O-CG2 3.31Å; R437-V441 WeakPolarHBondContact O-CG2 3.21Å; R437-V441 PolarHBondContact O-N 3.07Å; R437-D525 IonicContact CZ-OD1 2.73Å; R437-D525 IonicContact NH1-OD1 3.39Å; R437-D525 IonicContact NH2-OD1 2.76Å; R437-D525 PolarHBondContact NH2-OD1 2.93Å
438	V	95.7	Very high	92.7	Very high	6 Å²	6	21.7 Å²	21.7	4%	0.036	12%	0.12	C	C	.	.	H	α-helix	trans	-64.3	-39.8	174.4	174	0	0	0	0	111.6	V434 A435 T436 V441 R442 I513 H518 I523	V434-V438 HydrophobicContact CG1-CG2 4.41Å; V434-V438 WeakPolarHBondContact O-CG2 3.47Å; V434-V438 PolarHBondContact O-N 2.98Å; A435-V438 PolarHBondContact O-N 3.46Å; T436-V438 PolarHBondContact O-N 3.16Å; V438-V441 PolarHBondContact O-N 3.14Å; V438-R442 VanDerWaalsContact O-CG 3.31Å; V438-R442 WeakPolarHBondContact O-CG 3.25Å; V438-R442 PolarHBondContact O-N 3.26Å; V438-I513 HydrophobicContact CG1-CG2 4.38Å; V438-I513 HydrophobicContact CG2-CD1 3.9Å; V438-I513 HydrophobicContact CG2-CG1 4.23Å; V438-H518 HydrophobicContact CG1-CB 3.99Å; V438-H518 HydrophobicContact CG2-CB 4.23Å; V438-I523 HydrophobicContact CG2-CD1 3.86Å
439	A	95.4	Very high	93.5	Very high	3 Å²	3	19.6 Å²	19.6	3%	0.025	11%	0.109	C	C	.	.	H	α-helix	trans	-63.1	-43.8	176.1	0	0	0	0	0	111.8	L394 N397 L398 A435 T436 R442 F443	L394-A439 HydrophobicContact CD1-CB 4.19Å; N397-A439 HydrophobicContact CB-CB 3.72Å; L398-A439 HydrophobicContact CD2-CB 4.13Å; A435-A439 WeakPolarHBondContact O-CB 3.33Å; A435-A439 PolarHBondContact O-N 3.09Å; T436-A439 WeakPolarHBondContact O-CB 3.33Å; T436-A439 PolarHBondContact O-N 2.93Å; A439-R442 PolarHBondContact O-N 3.48Å; A439-F443 PolarHBondContact O-N 3.12Å
440	M	95.8	Very high	94	Very high	1 Å²	1	19.1 Å²	19.1	1%	0.005	11%	0.105	C	C	.	.	H	α-helix	trans	-62.8	-46.4	175.6	-70.5	-60.5	-55.1	0	0	112.2	L283 M312 L394 T436 R437 R442 F443 F444	L283-M440 HydrophobicContact CD2-CE 3.74Å; L283-M440 HydrophobicContact CD2-SD 3.87Å; M312-M440 VanDerWaalsContact O-CG 3.28Å; M312-M440 WeakPolarHBondContact O-CG 3.29Å; L394-M440 HydrophobicContact CD1-SD 3.88Å; L394-M440 HydrophobicContact CD2-SD 4.14Å; T436-M440 WeakPolarHBondContact O-CG 3.14Å; T436-M440 PolarHBondContact O-N 3.45Å; R437-M440 PolarHBondContact O-N 3.39Å; M440-R442 VanDerWaalsContact C-N 3.31Å; M440-R442 PolarHBondContact O-N 3.27Å; M440-F443 WeakPolarHBondContact O-CB 3.48Å; M440-F443 PolarHBondContact O-N 2.69Å; M440-F443 VanDerWaalsContact O-N 3.13Å; M440-F444 HydrophobicContact CE-CD2 4.36Å; M440-F444 HydrophobicContact CE-CE2 3.56Å; M440-F444 HydrophobicContact CE-CZ 4.04Å; M440-F444 WeakPolarHBondContact O-CD2 2.93Å; M440-F444 PolarHBondContact O-N 2.94Å
441	V	95.7	Very high	94.1	Very high	0 Å²	0	18.1 Å²	18.1	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-57.3	-43.1	174	172	0	0	0	0	111.6	Y314 R437 V438 F444 N445 F510 I513	Y314-V441 HydrophobicContact CD1-CG2 3.51Å; Y314-V441 HydrophobicContact CE1-CG2 3.5Å; Y314-V441 VanDerWaalsContact CE1-CG2 3.5Å; R437-V441 VanDerWaalsContact O-CG2 3.31Å; R437-V441 WeakPolarHBondContact O-CG2 3.21Å; R437-V441 PolarHBondContact O-N 3.07Å; V438-V441 PolarHBondContact O-N 3.14Å; V441-F444 PolarHBondContact O-N 3.05Å; V441-N445 WeakPolarHBondContact CG1-ND2 3.47Å; V441-N445 VanDerWaalsContact O-CB 3.3Å; V441-N445 WeakPolarHBondContact O-CB 3.41Å; V441-N445 VanDerWaalsContact O-CG 3.29Å; V441-N445 PolarHBondContact O-N 3.29Å; V441-N445 PolarHBondContact O-ND2 3.26Å; V441-F510 HydrophobicContact CG1-CD2 3.85Å; V441-F510 HydrophobicContact CG1-CE2 4.06Å; V441-I513 HydrophobicContact CB-CD1 4.13Å; V441-I513 HydrophobicContact CB-CG2 4.32Å; V441-I513 HydrophobicContact CG1-CB 4.15Å; V441-I513 HydrophobicContact CG1-CD1 4.09Å; V441-I513 HydrophobicContact CG1-CG2 3.66Å; V441-I513 HydrophobicContact CG2-CD1 3.96Å
442	R	95.4	Very high	94.1	Very high	112 Å²	112	20 Å²	20	42%	0.423	11%	0.107	S	C	.	.	H	α-helix	trans	-63.7	-40.2	175.9	-73.7	172.7	179.2	176.6	2.6	112.5	V438 A439 M440 S446	V438-R442 VanDerWaalsContact O-CG 3.31Å; V438-R442 WeakPolarHBondContact O-CG 3.25Å; V438-R442 PolarHBondContact O-N 3.26Å; A439-R442 PolarHBondContact O-N 3.48Å; M440-R442 VanDerWaalsContact C-N 3.31Å; M440-R442 PolarHBondContact O-N 3.27Å; R442-S446 PolarHBondContact O-N 3.46Å
443	F	96.2	Very high	94.2	Very high	9 Å²	9	20.3 Å²	20.3	4%	0.039	11%	0.108	C	C	.	.	H	α-helix	trans	-62.2	-48.8	175.5	168.8	-97.5	0	0	0	111.4	M287 L386 E390 L394 A439 M440 N445 S446 V449 F485	M287-F443 HydrophobicContact CE-CE1 4.17Å; L386-F443 HydrophobicContact CD1-CZ 4.48Å; L386-F443 HydrophobicContact CD2-CZ 4.03Å; E390-F443 HydrophobicContact CB-CD2 4.03Å; E390-F443 HydrophobicContact CB-CE2 3.95Å; L394-F443 HydrophobicContact CB-CD2 4.19Å; L394-F443 HydrophobicContact CD1-CB 4.15Å; L394-F443 HydrophobicContact CD2-CB 4.33Å; L394-F443 HydrophobicContact CD2-CD1 4.42Å; L394-F443 HydrophobicContact CD2-CD2 3.95Å; L394-F443 HydrophobicContact CD2-CE2 4.41Å; L394-F443 HydrophobicContact CD2-CG 3.97Å; A439-F443 PolarHBondContact O-N 3.12Å; M440-F443 WeakPolarHBondContact O-CB 3.48Å; M440-F443 PolarHBondContact O-N 2.69Å; M440-F443 VanDerWaalsContact O-N 3.13Å; F443-N445 PolarHBondContact O-N 3.38Å; F443-S446 VanDerWaalsContact O-CB 3.28Å; F443-S446 WeakPolarHBondContact O-CB 3.45Å; F443-S446 PolarHBondContact O-N 2.96Å; F443-S446 PolarHBondContact O-OG 3.22Å; F443-V449 HydrophobicContact CD1-CG1 4.35Å; F443-V449 HydrophobicContact CD2-CG2 4.32Å; F443-V449 HydrophobicContact CE1-CG1 3.83Å; F443-V449 HydrophobicContact CE1-CG2 4.15Å; F443-V449 HydrophobicContact CE2-CG2 3.75Å; F443-V449 HydrophobicContact CZ-CG1 4.11Å; F443-V449 HydrophobicContact CZ-CG2 3.64Å; F443-V449 WeakPolarHBondContact O-CB 3.36Å; F443-F485 HydrophobicContact CE1-CZ 4.31Å; F443-F485 HydrophobicContact CZ-CE1 4.04Å; F443-F485 HydrophobicContact CZ-CZ 4.07Å
444	F	95.8	Very high	94.2	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-61.4	-43.7	177.4	-76.5	-63.3	0	0	0	112.6	M287 L313 L316 M440 V441 S446 V449 L450 G451	M287-F444 HydrophobicContact CE-CD1 4.44Å; M287-F444 HydrophobicContact CE-CE1 3.28Å; M287-F444 HydrophobicContact CE-CZ 3.49Å; M287-F444 VanDerWaalsContact CE-CZ 3.49Å; M287-F444 HydrophobicContact SD-CE1 4.33Å; M287-F444 HydrophobicContact SD-CZ 3.94Å; L313-F444 WeakPolarHBondContact O-CE2 3.24Å; L316-F444 HydrophobicContact CB-CZ 4.47Å; L316-F444 HydrophobicContact CD1-CD1 4.2Å; L316-F444 HydrophobicContact CD1-CE1 3.33Å; L316-F444 HydrophobicContact CD1-CZ 3.55Å; L316-F444 HydrophobicContact CG-CD1 4.22Å; L316-F444 HydrophobicContact CG-CE1 3.69Å; L316-F444 HydrophobicContact CG-CE2 4.28Å; L316-F444 HydrophobicContact CG-CZ 3.73Å; M440-F444 HydrophobicContact CE-CD2 4.36Å; M440-F444 HydrophobicContact CE-CE2 3.56Å; M440-F444 HydrophobicContact CE-CZ 4.04Å; M440-F444 WeakPolarHBondContact O-CD2 2.93Å; M440-F444 PolarHBondContact O-N 2.94Å; V441-F444 PolarHBondContact O-N 3.05Å; F444-S446 PolarHBondContact O-N 2.89Å; F444-S446 VanDerWaalsContact O-N 3.1Å; F444-V449 HydrophobicContact CD1-CG1 4.02Å; F444-L450 HydrophobicContact CD1-CD1 3.74Å; F444-L450 HydrophobicContact CD1-CG 4.36Å; F444-L450 HydrophobicContact CE1-CD1 4.31Å; F444-L450 CarbonylContact O-C 3.55Å; F444-L450 VanDerWaalsContact O-CA 3.29Å; F444-L450 WeakPolarHBondContact O-CA 3.46Å; F444-L450 WeakPolarHBondContact O-CB 3.25Å; F444-L450 PolarHBondContact O-N 3.33Å; F444-G451 PolarHBondContact O-N 3.05Å
445	N	93	Very high	94	Very high	38 Å²	38	26.9 Å²	26.9	20%	0.203	14%	0.144	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.4	-0.5	179.5	-72.7	-25	0	0	0	114.7	V441 F443 G451 F510 H514	V441-N445 WeakPolarHBondContact CG1-ND2 3.47Å; V441-N445 VanDerWaalsContact O-CB 3.3Å; V441-N445 WeakPolarHBondContact O-CB 3.41Å; V441-N445 VanDerWaalsContact O-CG 3.29Å; V441-N445 PolarHBondContact O-N 3.29Å; V441-N445 PolarHBondContact O-ND2 3.26Å; F443-N445 PolarHBondContact O-N 3.38Å; N445-G451 WeakPolarHBondContact O-CA 3.43Å; N445-F510 WeakPolarHBondContact ND2-CE2 3.28Å; N445-F510 WeakPolarHBondContact OD1-CE2 3.5Å; N445-F510 WeakPolarHBondContact OD1-CZ 3.36Å; N445-H514 PolarHBondContact ND2-CE1 3.14Å; N445-H514 PolarHBondContact ND2-NE2 2.85Å; N445-H514 PolarHBondContact OD1-NE2 2.95Å
446	S	94.3	Very high	94	Very high	24 Å²	24	25.2 Å²	25.2	17%	0.168	13%	0.129	C	C	.	.	S	Bend	trans	-69	146.4	175.5	71	0	0	0	0	112.7	E390 R442 F443 F444 N448 V449 L450 G451	E390-S446 WeakPolarHBondContact CG-OG 3.32Å; R442-S446 PolarHBondContact O-N 3.46Å; F443-S446 VanDerWaalsContact O-CB 3.28Å; F443-S446 WeakPolarHBondContact O-CB 3.45Å; F443-S446 PolarHBondContact O-N 2.96Å; F443-S446 PolarHBondContact O-OG 3.22Å; F444-S446 PolarHBondContact O-N 2.89Å; F444-S446 VanDerWaalsContact O-N 3.1Å; S446-N448 PolarHBondContact O-N 3.32Å; S446-V449 PolarHBondContact O-N 3.39Å; S446-V449 VanDerWaalsContact OG-CB 3.3Å; S446-V449 WeakPolarHBondContact OG-CB 3.49Å; S446-V449 WeakPolarHBondContact OG-CG2 3.42Å; S446-L450 PolarHBondContact O-N 2.78Å; S446-G451 WeakPolarHBondContact O-CA 3.36Å; S446-G451 PolarHBondContact O-N 3.14Å
447	L	92	Very high	93.9	Very high	82 Å²	82	26 Å²	26	43%	0.429	13%	0.134	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-17.9	-176	-101.6	156.9	0	0	0	115	R479	L447-R479 WeakPolarHBondContact O-CD 3.45Å; L447-R479 VanDerWaalsContact O-CZ 3.26Å; L447-R479 PolarHBondContact O-NE 3.31Å; L447-R479 PolarHBondContact O-NH1 2.91Å
448	N	94	Very high	93.7	Very high	10 Å²	10	27.8 Å²	27.8	5%	0.053	14%	0.141	C	C	.	.	T	Hydrogen-bonded Turn	trans	-106.5	-4.1	178.2	-60.3	-57	0	0	0	113.7	E390 S446 Q480 T481 T486	E390-N448 WeakPolarHBondContact OE1-CB 3.37Å; E390-N448 PolarHBondContact OE1-ND2 2.86Å; S446-N448 PolarHBondContact O-N 3.32Å; N448-Q480 PolarHBondContact OD1-N 3.17Å; N448-T481 PolarHBondContact ND2-OG1 3.44Å; N448-T481 PolarHBondContact OD1-N 3.14Å; N448-T481 PolarHBondContact OD1-OG1 3.35Å; N448-T486 WeakPolarHBondContact O-CG2 3.34Å; N448-T486 PolarHBondContact O-OG1 3.34Å
449	V	95.2	Very high	93.5	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	15%	0.145	C	C	.	.	T	Hydrogen-bonded Turn	trans	-104	-88.8	175.3	-178.9	0	0	0	0	109.8	P387 E390 F443 F444 S446 F475 F485 L489	P387-V449 HydrophobicContact CG-CG2 4.1Å; E390-V449 HydrophobicContact CB-CG2 4.45Å; E390-V449 HydrophobicContact CG-CG2 4.36Å; F443-V449 HydrophobicContact CD1-CG1 4.35Å; F443-V449 HydrophobicContact CD2-CG2 4.32Å; F443-V449 HydrophobicContact CE1-CG1 3.83Å; F443-V449 HydrophobicContact CE1-CG2 4.15Å; F443-V449 HydrophobicContact CE2-CG2 3.75Å; F443-V449 HydrophobicContact CZ-CG1 4.11Å; F443-V449 HydrophobicContact CZ-CG2 3.64Å; F443-V449 WeakPolarHBondContact O-CB 3.36Å; F444-V449 HydrophobicContact CD1-CG1 4.02Å; S446-V449 PolarHBondContact O-N 3.39Å; S446-V449 VanDerWaalsContact OG-CB 3.3Å; S446-V449 WeakPolarHBondContact OG-CB 3.49Å; S446-V449 WeakPolarHBondContact OG-CG2 3.42Å; V449-F475 WeakPolarHBondContact O-CZ 3.38Å; V449-F485 HydrophobicContact CG1-CE1 4.27Å; V449-F485 HydrophobicContact CG2-CE1 4.4Å; V449-L489 HydrophobicContact CG1-CD2 3.89Å
450	L	95.5	Very high	93.4	Very high	1 Å²	1	28.4 Å²	28.4	1%	0.005	14%	0.144	C	C	.	.	T	Hydrogen-bonded Turn	trans	-128.5	7.2	179.4	-61.3	177.3	0	0	0	114.1	L316 F444 S446 N452 I453 F475 L489 V495 F498	L316-L450 HydrophobicContact CD1-CD1 4.48Å; L316-L450 HydrophobicContact CD2-CD1 3.85Å; F444-L450 HydrophobicContact CD1-CD1 3.74Å; F444-L450 HydrophobicContact CD1-CG 4.36Å; F444-L450 HydrophobicContact CE1-CD1 4.31Å; F444-L450 CarbonylContact O-C 3.55Å; F444-L450 VanDerWaalsContact O-CA 3.29Å; F444-L450 WeakPolarHBondContact O-CA 3.46Å; F444-L450 WeakPolarHBondContact O-CB 3.25Å; F444-L450 PolarHBondContact O-N 3.33Å; S446-L450 PolarHBondContact O-N 2.78Å; L450-N452 PolarHBondContact O-N 2.9Å; L450-I453 HydrophobicContact CD2-CD1 4.48Å; L450-I453 WeakPolarHBondContact O-CB 3.5Å; L450-I453 PolarHBondContact O-N 3.4Å; L450-I453 VanDerWaalsContact O-N 3.12Å; L450-F475 HydrophobicContact CD2-CZ 3.98Å; L450-L489 HydrophobicContact CD1-CD2 4.33Å; L450-L489 HydrophobicContact CD2-CD2 4.06Å; L450-L489 HydrophobicContact CD2-CG 4.43Å; L450-L489 HydrophobicContact CG-CD2 4.07Å; L450-V495 HydrophobicContact CD1-CG2 3.91Å; L450-V495 HydrophobicContact CD2-CG1 4.08Å; L450-V495 HydrophobicContact CD2-CG2 3.78Å; L450-F498 HydrophobicContact CB-CE1 4.38Å; L450-F498 HydrophobicContact CD1-CD1 3.97Å; L450-F498 HydrophobicContact CD1-CE1 4.16Å
451	G	92.1	Very high	93.2	Very high	2 Å²	2	28.5 Å²	28.5	2%	0.021	14%	0.144	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.8	138.3	179	0	0	0	0	0	113.2	F444 N445 S446 I453 R479	F444-G451 PolarHBondContact O-N 3.05Å; N445-G451 WeakPolarHBondContact O-CA 3.43Å; S446-G451 WeakPolarHBondContact O-CA 3.36Å; S446-G451 PolarHBondContact O-N 3.14Å; G451-I453 PolarHBondContact O-N 2.67Å; G451-R479 VanDerWaalsContact O-CZ 3.27Å; G451-R479 PolarHBondContact O-NH1 3.14Å; G451-R479 PolarHBondContact O-NH2 3.16Å
452	N	91.5	Very high	93	Very high	85 Å²	85	28.5 Å²	28.5	46%	0.455	14%	0.144	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.7	26.2	-175.2	-57.7	22.7	0	0	0	114.8	L450 T454 E455	L450-N452 PolarHBondContact O-N 2.9Å; N452-T454 PolarHBondContact O-N 3.4Å; N452-T454 VanDerWaalsContact O-N 3.16Å; N452-E455 HydrophobicContact CB-CG 4.3Å; N452-E455 PolarHBondContact ND2-OE1 3.34Å; N452-E455 PolarHBondContact O-N 3.43Å; N452-E455 VanDerWaalsContact O-N 3.14Å
453	I	92.8	Very high	92.8	Very high	7 Å²	7	23.6 Å²	23.6	4%	0.036	13%	0.126	C	C	.	.	G	3₁₀ helix	trans	-51.8	-38.3	177.4	-170.4	171.4	0	0	0	112.8	L450 G451 E455 H456 F470 F475 V495 F498 A499	L450-I453 HydrophobicContact CD2-CD1 4.48Å; L450-I453 WeakPolarHBondContact O-CB 3.5Å; L450-I453 PolarHBondContact O-N 3.4Å; L450-I453 VanDerWaalsContact O-N 3.12Å; G451-I453 PolarHBondContact O-N 2.67Å; I453-E455 VanDerWaalsContact C-N 3.26Å; I453-E455 PolarHBondContact O-N 2.82Å; I453-H456 CarbonylContact O-C 3.5Å; I453-H456 WeakPolarHBondContact O-CA 3.27Å; I453-H456 WeakPolarHBondContact O-CB 3.37Å; I453-H456 PolarHBondContact O-N 3.25Å; I453-F470 HydrophobicContact CD1-CD2 4.36Å; I453-F470 HydrophobicContact CD1-CE2 4.03Å; I453-F470 HydrophobicContact CG1-CD2 4.14Å; I453-F470 HydrophobicContact CG1-CE2 3.75Å; I453-F475 HydrophobicContact CB-CE2 4.3Å; I453-F475 HydrophobicContact CG1-CD2 4.43Å; I453-F475 HydrophobicContact CG1-CE2 4.39Å; I453-V495 HydrophobicContact CD1-CG1 3.71Å; I453-F498 HydrophobicContact CD1-CD1 4.17Å; I453-F498 HydrophobicContact CG2-CD1 4.3Å; I453-F498 HydrophobicContact CG2-CE1 3.86Å; I453-A499 HydrophobicContact CD1-CB 4.28Å
454	T	90.8	Very high	92.2	Very high	77 Å²	77	26.4 Å²	26.4	47%	0.472	15%	0.145	S	C	.	.	G	3₁₀ helix	trans	-60.9	-28.6	-178	50.5	0	0	0	0	113.8	N452 H456 T457 C502	N452-T454 PolarHBondContact O-N 3.4Å; N452-T454 VanDerWaalsContact O-N 3.16Å; T454-H456 PolarHBondContact O-N 3.02Å; T454-T457 WeakPolarHBondContact CA-OG1 3.26Å; T454-T457 PolarHBondContact O-N 2.92Å; T454-T457 PolarHBondContact O-OG1 2.77Å; T454-C502 HydrophobicContact CG2-CB 3.77Å
455	E	90.4	Very high	91.6	Very high	65 Å²	65	31.4 Å²	31.4	30%	0.304	16%	0.164	S	C	.	.	G	3₁₀ helix	trans	-62.2	-27.7	172.8	-66.7	-172.3	-140.4	0	0	112.3	N452 I453 R458 S859 I1054	N452-E455 HydrophobicContact CB-CG 4.3Å; N452-E455 PolarHBondContact ND2-OE1 3.34Å; N452-E455 PolarHBondContact O-N 3.43Å; N452-E455 VanDerWaalsContact O-N 3.14Å; I453-E455 VanDerWaalsContact C-N 3.26Å; I453-E455 PolarHBondContact O-N 2.82Å; E455-R458 PolarHBondContact O-NH1 3.12Å; E455-S859 WeakPolarHBondContact OE2-CB 3.32Å; E455-S859 PolarHBondContact OE2-OG 3.09Å; E455-I1054 HydrophobicContact CB-CD1 4.18Å; E455-I1054 WeakPolarHBondContact O-CG2 3.25Å
456	H	92.6	Very high	91.4	Very high	4 Å²	4	30.9 Å²	30.9	2%	0.019	16%	0.163	C	C	.	.	G	3₁₀ helix	trans	-100.7	23.1	-179.3	-54.6	-77.6	0	0	0	112.6	I453 T454 F470 Q471 S474 F475 S478	I453-H456 CarbonylContact O-C 3.5Å; I453-H456 WeakPolarHBondContact O-CA 3.27Å; I453-H456 WeakPolarHBondContact O-CB 3.37Å; I453-H456 PolarHBondContact O-N 3.25Å; T454-H456 PolarHBondContact O-N 3.02Å; H456-F470 HydrophobicContact CB-CE2 4.47Å; H456-Q471 WeakPolarHBondContact O-CB 3.3Å; H456-Q471 PolarHBondContact O-N 2.9Å; H456-S474 PolarHBondContact CE1-O 3.44Å; H456-S474 VanDerWaalsContact ND1-C 3.3Å; H456-S474 WeakPolarHBondContact ND1-CB 3.39Å; H456-S474 PolarHBondContact ND1-OG 3.47Å; H456-F475 HydrophobicContact CB-CB 3.82Å; H456-F475 HydrophobicContact CB-CD2 4.47Å; H456-F475 AromaticContact CD2-CD2 3.81Å; H456-F475 PolarHBondContact ND1-N 3.32Å; H456-S478 WeakPolarHBondContact NE2-CB 3.45Å; H456-S478 PolarHBondContact NE2-OG 2.87Å
457	T	92.2	Very high	91.2	Very high	18 Å²	18	30 Å²	30	11%	0.11	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	153.6	176.7	61.1	0	0	0	0	112	T454 V468 A469 F470 A499	T454-T457 WeakPolarHBondContact CA-OG1 3.26Å; T454-T457 PolarHBondContact O-N 2.92Å; T454-T457 PolarHBondContact O-OG1 2.77Å; T457-V468 HydrophobicContact CG2-CG1 3.84Å; T457-A469 CarbonylContact C-O 3.58Å; T457-A469 VanDerWaalsContact CA-O 3.31Å; T457-A469 WeakPolarHBondContact CA-O 3.34Å; T457-F470 HydrophobicContact CG2-CD2 4.41Å; T457-A499 HydrophobicContact CG2-CB 3.71Å
458	R	90.8	Very high	91.2	Very high	40 Å²	40	26.1 Å²	26.1	15%	0.151	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	124.9	171.9	-60.6	-68.5	177.1	-98.7	3.4	109.2	E455 I460 V468 A469 G1055 F1282 D1283 A1286	E455-R458 PolarHBondContact O-NH1 3.12Å; R458-I460 PolarHBondContact O-N 2.93Å; R458-V468 WeakPolarHBondContact O-CA 3.48Å; R458-A469 HydrophobicContact CB-CB 4.3Å; R458-A469 PolarHBondContact N-O 3.34Å; R458-A469 PolarHBondContact O-N 2.9Å; R458-G1055 VanDerWaalsContact NH2-N 3.11Å; R458-F1282 HydrophobicContact CB-CB 4.22Å; R458-F1282 HydrophobicContact CG-CB 4.18Å; R458-D1283 IonicContact CZ-OD1 2.86Å; R458-D1283 IonicContact NE-OD1 2.95Å; R458-D1283 PolarHBondContact NE-OD1 3.27Å; R458-D1283 IonicContact NH2-OD1 3.84Å; R458-A1286 HydrophobicContact CB-CB 4.43Å
459	T	92.5	Very high	91	Very high	19 Å²	19	25.7 Å²	25.7	12%	0.117	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.3	117.5	170.3	-49.4	0	0	0	0	108.4	L462 L503 R1289	T459-L462 HydrophobicContact CG2-CD2 3.88Å; T459-L462 HydrophobicContact CG2-CG 4.01Å; T459-L503 HydrophobicContact CG2-CD1 4.06Å; T459-R1289 VanDerWaalsContact O-CD 3.26Å; T459-R1289 WeakPolarHBondContact O-CD 3.34Å
460	I	92.8	Very high	90.8	Very high	2 Å²	2	26.8 Å²	26.8	1%	0.01	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	-49.1	170.5	-53.8	-178.1	0	0	0	108	R458 V467 A469 F1282 R1289 L1324 R1355 C1356	R458-I460 PolarHBondContact O-N 2.93Å; I460-V467 HydrophobicContact CB-CB 4.46Å; I460-V467 HydrophobicContact CB-CG1 4.38Å; I460-V467 HydrophobicContact CD1-CG1 4.12Å; I460-V467 PolarHBondContact N-O 3Å; I460-A469 HydrophobicContact CD1-CB 4.02Å; I460-A469 HydrophobicContact CG1-CB 4.09Å; I460-F1282 HydrophobicContact CD1-CD1 4.06Å; I460-F1282 HydrophobicContact CD1-CE1 3.65Å; I460-F1282 HydrophobicContact CD1-CZ 4.48Å; I460-F1282 HydrophobicContact CG1-CD1 4.24Å; I460-F1282 HydrophobicContact CG1-CE1 4.33Å; I460-R1289 PolarHBondContact O-NH1 3.33Å; I460-L1324 HydrophobicContact CG2-CD1 4.16Å; I460-L1324 HydrophobicContact CG2-CD2 3.52Å; I460-R1355 HydrophobicContact CD1-CG 4.43Å; I460-C1356 HydrophobicContact CG2-CB 4.47Å
461	R	92	Very high	90.6	Very high	4 Å²	4	27.1 Å²	27.1	2%	0.015	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.3	152	-170.4	-159	171.8	-173.7	175.2	2.2	111.1	F463 P466 V467 M1317 E1320 D1321 L1324 R1357	R461-F463 WeakPolarHBondContact CD-O 3.22Å; R461-F463 WeakPolarHBondContact CG-O 3.42Å; R461-F463 VanDerWaalsContact CZ-O 3.29Å; R461-F463 PolarHBondContact NE-O 3.09Å; R461-P466 CarbonylContact O-C 3.6Å; R461-P466 WeakPolarHBondContact O-CA 3.49Å; R461-V467 HydrophobicContact CB-CB 4.18Å; R461-V467 HydrophobicContact CB-CG2 4.35Å; R461-V467 PolarHBondContact N-O 3.28Å; R461-V467 PolarHBondContact O-N 2.96Å; R461-M1317 PolarHBondContact NH2-O 2.99Å; R461-E1320 HydrophobicContact CG-CB 4.19Å; R461-E1320 VanDerWaalsContact CG-CD 3.49Å; R461-E1320 HydrophobicContact CG-CG 4.48Å; R461-E1320 WeakPolarHBondContact CG-OE2 3.16Å; R461-E1320 IonicContact NE-OE2 2.63Å; R461-E1320 PolarHBondContact NE-OE2 3.16Å; R461-D1321 IonicContact CZ-OD1 2.72Å; R461-D1321 IonicContact CZ-OD2 2.88Å; R461-D1321 IonicContact NH1-OD1 2.7Å; R461-D1321 PolarHBondContact NH1-OD1 3.49Å; R461-D1321 IonicContact NH1-OD2 2.65Å; R461-D1321 IonicContact NH2-OD1 2.69Å; R461-D1321 PolarHBondContact NH2-OD1 2.92Å; R461-D1321 VanDerWaalsContact NH2-OD1 3.09Å; R461-D1321 IonicContact NH2-OD2 3.6Å; R461-D1321 PolarHBondContact NH2-OD2 2.98Å; R461-L1324 HydrophobicContact CB-CD1 4.21Å; R461-L1324 HydrophobicContact CG-CD1 4.19Å; R461-R1357 PolarHBondContact NH1-O 2.97Å
462	L	90.8	Very high	90.5	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	15%	0.149	C	C	.	.			trans	-110.8	-32	170.1	-71	175.6	0	0	0	113.6	T459 R465 P466 L503 L1294 P1298 M1301 L1302 E1320	T459-L462 HydrophobicContact CG2-CD2 3.88Å; T459-L462 HydrophobicContact CG2-CG 4.01Å; L462-R465 CarbonylContact C-O 3.57Å; L462-R465 CarbonylContact O-C 3.55Å; L462-R465 WeakPolarHBondContact O-CA 3.47Å; L462-R465 PolarHBondContact O-N 2.92Å; L462-P466 HydrophobicContact CD2-CB 4.45Å; L462-P466 HydrophobicContact CD2-CG 4.45Å; L462-P466 VanDerWaalsContact O-N 3.11Å; L462-L503 HydrophobicContact CD2-CD1 4.26Å; L462-L1294 WeakPolarHBondContact CD1-O 3.48Å; L462-P1298 HydrophobicContact CD1-CB 3.99Å; L462-P1298 HydrophobicContact CD2-CB 3.93Å; L462-M1301 HydrophobicContact CD1-CE 3.66Å; L462-L1302 WeakPolarHBondContact O-CD2 3.44Å; L462-E1320 PolarHBondContact N-OE1 2.95Å; L462-E1320 PolarHBondContact N-OE2 3.49Å
463	F	90.5	Very high	90.4	Very high	9 Å²	9	29.5 Å²	29.5	4%	0.039	15%	0.146	C	C	.	.	S	Bend	trans	-114.8	149.9	-171.4	-49.9	-67.1	0	0	0	112.6	R461 M1301 L1302 F1305 V1316 M1317 E1320	R461-F463 WeakPolarHBondContact CD-O 3.22Å; R461-F463 WeakPolarHBondContact CG-O 3.42Å; R461-F463 VanDerWaalsContact CZ-O 3.29Å; R461-F463 PolarHBondContact NE-O 3.09Å; F463-M1301 WeakPolarHBondContact CE1-O 3.47Å; F463-M1301 HydrophobicContact CZ-CB 4.09Å; F463-L1302 HydrophobicContact CD1-CD2 4.18Å; F463-L1302 HydrophobicContact CE1-CD2 4.11Å; F463-F1305 HydrophobicContact CB-CD2 4.18Å; F463-F1305 HydrophobicContact CB-CE2 3.8Å; F463-F1305 HydrophobicContact CB-CZ 4.03Å; F463-F1305 HydrophobicContact CD1-CB 3.64Å; F463-F1305 AromaticContact CD1-CD1 3.82Å; F463-F1305 HydrophobicContact CD1-CD1 3.82Å; F463-F1305 AromaticContact CD1-CD2 3.34Å; F463-F1305 HydrophobicContact CD1-CD2 3.34Å; F463-F1305 HydrophobicContact CD1-CE1 4.3Å; F463-F1305 AromaticContact CD1-CE2 3.86Å; F463-F1305 HydrophobicContact CD1-CE2 3.86Å; F463-F1305 AromaticContact CD1-CG 3.31Å; F463-F1305 HydrophobicContact CD1-CG 3.31Å; F463-F1305 HydrophobicContact CD1-CZ 4.31Å; F463-F1305 HydrophobicContact CE1-CB 3.34Å; F463-F1305 HydrophobicContact CE1-CD1 4.4Å; F463-F1305 AromaticContact CE1-CD2 3.8Å; F463-F1305 HydrophobicContact CE1-CD2 3.8Å; F463-F1305 AromaticContact CE1-CG 3.62Å; F463-F1305 HydrophobicContact CE1-CG 3.62Å; F463-F1305 AromaticContact CG-CD2 3.78Å; F463-F1305 HydrophobicContact CG-CD2 3.78Å; F463-F1305 AromaticContact CG-CE2 3.93Å; F463-F1305 HydrophobicContact CG-CE2 3.93Å; F463-F1305 HydrophobicContact CG-CG 4.21Å; F463-F1305 HydrophobicContact CG-CZ 4.49Å; F463-F1305 HydrophobicContact CZ-CB 4.29Å; F463-V1316 HydrophobicContact CD2-CG1 3.32Å; F463-V1316 HydrophobicContact CE2-CG1 3.31Å; F463-V1316 HydrophobicContact CG-CG1 4.06Å; F463-V1316 HydrophobicContact CZ-CG1 4.06Å; F463-M1317 HydrophobicContact CB-CG 4.05Å; F463-E1320 WeakPolarHBondContact CB-OE2 3.2Å; F463-E1320 HydrophobicContact CD2-CG 4.4Å; F463-E1320 WeakPolarHBondContact CD2-OE2 3.39Å; F463-E1320 PolarHBondContact N-OE2 3.25Å
464	P	85.3	Confident	90.3	Very high	68 Å²	68	29.6 Å²	29.6	44%	0.442	15%	0.147	S	C	.	.	S	Bend	cis	-71.6	-3.9	-13.3	34.1	-36.4	0	0	0	112.5	F1305 M1317	P464-F1305 HydrophobicContact CB-CE1 4.15Å; P464-F1305 HydrophobicContact CB-CZ 4.12Å; P464-M1317 HydrophobicContact CB-SD 4.27Å; P464-M1317 HydrophobicContact CG-CE 4.34Å
465	R	83	Confident	90.4	Very high	105 Å²	105	25.9 Å²	25.9	40%	0.396	13%	0.125	S	C	.	.	S	Bend	trans	-140.8	145.5	173	-72.7	-173.8	167.4	152.9	-3	110.4	F2 N4 L462	F2-R465 PolarHBondContact O-NH2 3.46Å; N4-R465 PolarHBondContact OD1-NH2 2.9Å; L462-R465 CarbonylContact C-O 3.57Å; L462-R465 CarbonylContact O-C 3.55Å; L462-R465 WeakPolarHBondContact O-CA 3.47Å; L462-R465 PolarHBondContact O-N 2.92Å
466	P	88.3	Confident	90.5	Very high	27 Å²	27	23.8 Å²	23.8	18%	0.175	12%	0.115	C	C	.	.			trans	-55.9	142.5	171.2	-26.9	36.5	0	0	0	112.3	R461 L462 L503 L1302	R461-P466 CarbonylContact O-C 3.6Å; R461-P466 WeakPolarHBondContact O-CA 3.49Å; L462-P466 HydrophobicContact CD2-CB 4.45Å; L462-P466 HydrophobicContact CD2-CG 4.45Å; L462-P466 VanDerWaalsContact O-N 3.11Å; P466-L503 HydrophobicContact CB-CD1 4.25Å; P466-L1302 HydrophobicContact CG-CD1 3.75Å; P466-L1302 HydrophobicContact CG-CD2 4.09Å
467	V	90.3	Very high	90.4	Very high	4 Å²	4	28.8 Å²	28.8	2%	0.024	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	129.1	172.2	-177	0	0	0	0	109	I460 R461 E500 R1355	I460-V467 HydrophobicContact CB-CB 4.46Å; I460-V467 HydrophobicContact CB-CG1 4.38Å; I460-V467 HydrophobicContact CD1-CG1 4.12Å; I460-V467 PolarHBondContact N-O 3Å; R461-V467 HydrophobicContact CB-CB 4.18Å; R461-V467 HydrophobicContact CB-CG2 4.35Å; R461-V467 PolarHBondContact N-O 3.28Å; R461-V467 PolarHBondContact O-N 2.96Å; V467-E500 WeakPolarHBondContact CA-OE1 3.36Å; V467-R1355 WeakPolarHBondContact CG1-O 3.4Å
468	V	91.2	Very high	90.3	Very high	2 Å²	2	29.4 Å²	29.4	1%	0.012	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	135.8	-173.5	179.5	0	0	0	0	111.6	T457 R458 A499 E500 L503 R1355	T457-V468 HydrophobicContact CG2-CG1 3.84Å; R458-V468 WeakPolarHBondContact O-CA 3.48Å; V468-A499 HydrophobicContact CG1-CB 4.24Å; V468-E500 HydrophobicContact CB-CG 3.7Å; V468-E500 HydrophobicContact CG2-CB 4.4Å; V468-E500 HydrophobicContact CG2-CG 3.92Å; V468-E500 PolarHBondContact N-OE1 3.2Å; V468-L503 HydrophobicContact CG2-CD1 3.36Å; V468-L503 HydrophobicContact CG2-CG 3.99Å; V468-R1355 PolarHBondContact O-NH2 3.39Å; V468-R1355 VanDerWaalsContact O-NH2 3.1Å
469	A	90.9	Very high	90.4	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	124.1	164.3	0	0	0	0	0	110	T457 R458 I460 F1282	T457-A469 CarbonylContact C-O 3.58Å; T457-A469 VanDerWaalsContact CA-O 3.31Å; T457-A469 WeakPolarHBondContact CA-O 3.34Å; R458-A469 HydrophobicContact CB-CB 4.3Å; R458-A469 PolarHBondContact N-O 3.34Å; R458-A469 PolarHBondContact O-N 2.9Å; I460-A469 HydrophobicContact CD1-CB 4.02Å; I460-A469 HydrophobicContact CG1-CB 4.09Å; A469-F1282 HydrophobicContact CB-CB 4.2Å; A469-F1282 HydrophobicContact CB-CD1 3.61Å; A469-F1282 HydrophobicContact CB-CD2 3.43Å; A469-F1282 VanDerWaalsContact CB-CD2 3.43Å; A469-F1282 HydrophobicContact CB-CE1 3.72Å; A469-F1282 HydrophobicContact CB-CE2 3.5Å; A469-F1282 VanDerWaalsContact CB-CE2 3.5Å; A469-F1282 HydrophobicContact CB-CG 3.48Å; A469-F1282 VanDerWaalsContact CB-CG 3.48Å; A469-F1282 HydrophobicContact CB-CZ 3.67Å
470	F	91	Very high	90.2	Very high	23 Å²	23	32.7 Å²	32.7	10%	0.101	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95	112.7	172.7	173.8	-127.3	0	0	0	110.3	I453 H456 T457 K472 F475 A490 V495	I453-F470 HydrophobicContact CD1-CD2 4.36Å; I453-F470 HydrophobicContact CD1-CE2 4.03Å; I453-F470 HydrophobicContact CG1-CD2 4.14Å; I453-F470 HydrophobicContact CG1-CE2 3.75Å; H456-F470 HydrophobicContact CB-CE2 4.47Å; T457-F470 HydrophobicContact CG2-CD2 4.41Å; F470-K472 HydrophobicContact CD1-CB 4.06Å; F470-K472 HydrophobicContact CE1-CB 3.87Å; F470-K472 HydrophobicContact CE1-CG 4.25Å; F470-K472 PolarHBondContact O-N 2.88Å; F470-F475 HydrophobicContact CE2-CB 3.6Å; F470-F475 HydrophobicContact CE2-CD1 4.23Å; F470-F475 AromaticContact CE2-CD2 3.97Å; F470-F475 HydrophobicContact CE2-CD2 3.97Å; F470-F475 AromaticContact CE2-CG 3.66Å; F470-F475 HydrophobicContact CE2-CG 3.66Å; F470-F475 HydrophobicContact CZ-CB 3.67Å; F470-F475 AromaticContact CZ-CD1 3.61Å; F470-F475 HydrophobicContact CZ-CD1 3.61Å; F470-F475 HydrophobicContact CZ-CD2 4.16Å; F470-F475 HydrophobicContact CZ-CE1 4.28Å; F470-F475 AromaticContact CZ-CG 3.53Å; F470-F475 HydrophobicContact CZ-CG 3.53Å; F470-A490 HydrophobicContact CE1-CB 4.14Å; F470-A490 HydrophobicContact CZ-CB 4.31Å; F470-V495 HydrophobicContact CD1-CG1 4.47Å; F470-V495 HydrophobicContact CE1-CG1 4.05Å; F470-V495 HydrophobicContact CZ-CG1 4.23Å
471	Q	90.3	Very high	90.1	Very high	8 Å²	8	36.3 Å²	36.3	4%	0.037	18%	0.179	C	C	.	.			trans	-77.8	67.2	178.8	-68.2	-177.3	-29.8	0	0	110.6	H456 F473 S474 F475 D1283	H456-Q471 WeakPolarHBondContact O-CB 3.3Å; H456-Q471 PolarHBondContact O-N 2.9Å; Q471-F473 VanDerWaalsContact C-N 3.3Å; Q471-F473 PolarHBondContact O-N 2.96Å; Q471-F473 VanDerWaalsContact O-N 3.12Å; Q471-S474 WeakPolarHBondContact O-CA 3.41Å; Q471-S474 VanDerWaalsContact O-CB 3.26Å; Q471-S474 WeakPolarHBondContact O-CB 3.4Å; Q471-S474 PolarHBondContact O-N 2.81Å; Q471-F475 PolarHBondContact O-N 3.19Å; Q471-D1283 PolarHBondContact NE2-OD1 3Å; Q471-D1283 VanDerWaalsContact NE2-OD1 3.11Å
472	K	90.7	Very high	90.1	Very high	51 Å²	51	39.6 Å²	39.6	22%	0.222	20%	0.197	C	C	.	.	H	α-helix	trans	-44.5	-46.3	-175	176.3	-172.9	167.8	-165.8	0	114.2	F470 F475 L476 E491	F470-K472 HydrophobicContact CD1-CB 4.06Å; F470-K472 HydrophobicContact CE1-CB 3.87Å; F470-K472 HydrophobicContact CE1-CG 4.25Å; F470-K472 PolarHBondContact O-N 2.88Å; K472-F475 WeakPolarHBondContact O-CB 3.5Å; K472-F475 PolarHBondContact O-N 2.91Å; K472-L476 HydrophobicContact CG-CD1 3.89Å; K472-L476 HydrophobicContact CG-CG 4.31Å; K472-L476 WeakPolarHBondContact O-CB 3.31Å; K472-L476 VanDerWaalsContact O-CG 3.28Å; K472-L476 WeakPolarHBondContact O-CG 3.45Å; K472-L476 PolarHBondContact O-N 3.35Å; K472-E491 HydrophobicContact CD-CG 4.29Å; K472-E491 VanDerWaalsContact CE-CG 3.44Å; K472-E491 WeakPolarHBondContact CE-OE1 3.42Å; K472-E491 VanDerWaalsContact NZ-CD 3.31Å; K472-E491 IonicContact NZ-OE1 2.82Å; K472-E491 PolarHBondContact NZ-OE1 2.68Å
473	F	89.4	Confident	90.3	Very high	86 Å²	86	40.7 Å²	40.7	38%	0.377	20%	0.203	S	C	.	.	H	α-helix	trans	-67.5	-37.8	-178.1	-64.9	-78.8	0	0	0	112.9	Q471 K477 H1052 Q1275	Q471-F473 VanDerWaalsContact C-N 3.3Å; Q471-F473 PolarHBondContact O-N 2.96Å; Q471-F473 VanDerWaalsContact O-N 3.12Å; F473-K477 WeakPolarHBondContact O-CB 3.25Å; F473-K477 PolarHBondContact O-N 2.75Å; F473-H1052 HydrophobicContact CB-CB 4.38Å; F473-Q1275 HydrophobicContact CD2-CG 4Å; F473-Q1275 HydrophobicContact CE2-CG 4.06Å
474	S	89.8	Confident	90.5	Very high	9 Å²	9	44 Å²	44	6%	0.063	23%	0.226	C	C	.	.	H	α-helix	trans	-61.8	-47.5	172.8	-171.3	0	0	0	0	110.7	H456 Q471 K477 S478 H1052 G1053 I1054	H456-S474 PolarHBondContact CE1-O 3.44Å; H456-S474 VanDerWaalsContact ND1-C 3.3Å; H456-S474 WeakPolarHBondContact ND1-CB 3.39Å; H456-S474 PolarHBondContact ND1-OG 3.47Å; Q471-S474 WeakPolarHBondContact O-CA 3.41Å; Q471-S474 VanDerWaalsContact O-CB 3.26Å; Q471-S474 WeakPolarHBondContact O-CB 3.4Å; Q471-S474 PolarHBondContact O-N 2.81Å; S474-K477 PolarHBondContact O-N 2.92Å; S474-S478 PolarHBondContact O-N 3.45Å; S474-S478 VanDerWaalsContact O-N 3.11Å; S474-H1052 WeakPolarHBondContact CA-O 3.46Å; S474-G1053 VanDerWaalsContact CB-O 3.26Å; S474-G1053 WeakPolarHBondContact CB-O 3.46Å; S474-G1053 VanDerWaalsContact OG-C 3.23Å; S474-G1053 PolarHBondContact OG-O 3.15Å; S474-I1054 WeakPolarHBondContact OG-CG1 3.44Å; S474-I1054 PolarHBondContact OG-N 3.24Å
475	F	92.9	Very high	91	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-58.2	-51.8	176.2	174	-95.7	0	0	0	112.3	V449 L450 I453 H456 F470 Q471 K472 K477 S478 R479 T486 A490	V449-F475 WeakPolarHBondContact O-CZ 3.38Å; L450-F475 HydrophobicContact CD2-CZ 3.98Å; I453-F475 HydrophobicContact CB-CE2 4.3Å; I453-F475 HydrophobicContact CG1-CD2 4.43Å; I453-F475 HydrophobicContact CG1-CE2 4.39Å; H456-F475 HydrophobicContact CB-CB 3.82Å; H456-F475 HydrophobicContact CB-CD2 4.47Å; H456-F475 AromaticContact CD2-CD2 3.81Å; H456-F475 PolarHBondContact ND1-N 3.32Å; F470-F475 HydrophobicContact CE2-CB 3.6Å; F470-F475 HydrophobicContact CE2-CD1 4.23Å; F470-F475 AromaticContact CE2-CD2 3.97Å; F470-F475 HydrophobicContact CE2-CD2 3.97Å; F470-F475 AromaticContact CE2-CG 3.66Å; F470-F475 HydrophobicContact CE2-CG 3.66Å; F470-F475 HydrophobicContact CZ-CB 3.67Å; F470-F475 AromaticContact CZ-CD1 3.61Å; F470-F475 HydrophobicContact CZ-CD1 3.61Å; F470-F475 HydrophobicContact CZ-CD2 4.16Å; F470-F475 HydrophobicContact CZ-CE1 4.28Å; F470-F475 AromaticContact CZ-CG 3.53Å; F470-F475 HydrophobicContact CZ-CG 3.53Å; Q471-F475 PolarHBondContact O-N 3.19Å; K472-F475 WeakPolarHBondContact O-CB 3.5Å; K472-F475 PolarHBondContact O-N 2.91Å; F475-K477 VanDerWaalsContact C-N 3.29Å; F475-K477 PolarHBondContact O-N 3.25Å; F475-S478 WeakPolarHBondContact O-CB 3.26Å; F475-S478 PolarHBondContact O-N 3.43Å; F475-S478 VanDerWaalsContact O-N 3.09Å; F475-S478 PolarHBondContact O-OG 3.2Å; F475-R479 VanDerWaalsContact CE2-CZ 3.49Å; F475-R479 PolarHBondContact O-NE 3.26Å; F475-T486 HydrophobicContact CE1-CG2 4.34Å; F475-A490 HydrophobicContact CD1-CB 4.09Å; F475-A490 HydrophobicContact CE1-CB 4.02Å
476	L	92.8	Very high	91.6	Very high	20 Å²	20	35.8 Å²	35.8	11%	0.105	19%	0.186	C	C	.	.	H	α-helix	trans	-63	-34.1	-178.8	-69	175.9	0	0	0	112.5	K472 S478 L482 R487 A490	K472-L476 HydrophobicContact CG-CD1 3.89Å; K472-L476 HydrophobicContact CG-CG 4.31Å; K472-L476 WeakPolarHBondContact O-CB 3.31Å; K472-L476 VanDerWaalsContact O-CG 3.28Å; K472-L476 WeakPolarHBondContact O-CG 3.45Å; K472-L476 PolarHBondContact O-N 3.35Å; L476-S478 VanDerWaalsContact C-N 3.35Å; L476-L482 HydrophobicContact CD2-CD1 3.74Å; L476-R487 HydrophobicContact CD1-CG 4.42Å; L476-A490 HydrophobicContact CD2-CB 3.87Å; L476-A490 HydrophobicContact CG-CB 4.45Å
477	K	90.4	Very high	92	Very high	110 Å²	110	40.1 Å²	40.1	48%	0.478	20%	0.199	S	C	.	.	H	α-helix	trans	-71.8	-26.7	175.7	-172.4	175.5	175.6	-179.5	0	113.2	F473 S474 F475 R479 N1051 H1052	F473-K477 WeakPolarHBondContact O-CB 3.25Å; F473-K477 PolarHBondContact O-N 2.75Å; S474-K477 PolarHBondContact O-N 2.92Å; F475-K477 VanDerWaalsContact C-N 3.29Å; F475-K477 PolarHBondContact O-N 3.25Å; K477-R479 VanDerWaalsContact C-N 3.29Å; K477-R479 PolarHBondContact O-N 3.41Å; K477-N1051 WeakPolarHBondContact CD-O 3.4Å; K477-N1051 WeakPolarHBondContact CE-O 3.33Å; K477-N1051 PolarHBondContact NZ-O 3.34Å; K477-N1051 PolarHBondContact NZ-OD1 3.01Å; K477-H1052 HydrophobicContact CD-CB 4.03Å
478	S	91	Very high	92.3	Very high	30 Å²	30	42.4 Å²	42.4	21%	0.21	21%	0.208	C	C	.	.	H	α-helix	trans	-71.1	-20.5	179.1	75.9	0	0	0	0	114.5	H456 S474 F475 L476 M863	H456-S478 WeakPolarHBondContact NE2-CB 3.45Å; H456-S478 PolarHBondContact NE2-OG 2.87Å; S474-S478 PolarHBondContact O-N 3.45Å; S474-S478 VanDerWaalsContact O-N 3.11Å; F475-S478 WeakPolarHBondContact O-CB 3.26Å; F475-S478 PolarHBondContact O-N 3.43Å; F475-S478 VanDerWaalsContact O-N 3.09Å; F475-S478 PolarHBondContact O-OG 3.2Å; L476-S478 VanDerWaalsContact C-N 3.35Å; S478-M863 WeakPolarHBondContact O-CE 3.29Å
479	R	92	Very high	92.5	Very high	15 Å²	15	42.3 Å²	42.3	6%	0.057	21%	0.208	C	C	.	.			trans	-68.3	135.6	-173.9	-55.8	-61.1	86.4	172.7	4.4	110.8	L447 G451 F475 K477 L482 T486	L447-R479 WeakPolarHBondContact O-CD 3.45Å; L447-R479 VanDerWaalsContact O-CZ 3.26Å; L447-R479 PolarHBondContact O-NE 3.31Å; L447-R479 PolarHBondContact O-NH1 2.91Å; G451-R479 VanDerWaalsContact O-CZ 3.27Å; G451-R479 PolarHBondContact O-NH1 3.14Å; G451-R479 PolarHBondContact O-NH2 3.16Å; F475-R479 VanDerWaalsContact CE2-CZ 3.49Å; F475-R479 PolarHBondContact O-NE 3.26Å; K477-R479 VanDerWaalsContact C-N 3.29Å; K477-R479 PolarHBondContact O-N 3.41Å; R479-L482 HydrophobicContact CB-CB 4.45Å; R479-T486 HydrophobicContact CG-CG2 4.29Å
480	Q	88.6	Confident	92.7	Very high	113 Å²	113	42.5 Å²	42.5	53%	0.528	21%	0.209	S	C	.	.	S	Bend	trans	-70.3	-42.9	177.3	-64.9	-178	3.6	0	0	111.4	N448 M863	N448-Q480 PolarHBondContact OD1-N 3.17Å; Q480-M863 HydrophobicContact CG-CE 3.93Å; Q480-M863 HydrophobicContact CG-SD 4.24Å
481	T	91.5	Very high	92.9	Very high	78 Å²	78	46.8 Å²	46.8	48%	0.479	23%	0.23	S	C	.	.	S	Bend	trans	-127.8	95.2	174.1	54.3	0	0	0	0	109.7	N448 T483	N448-T481 PolarHBondContact ND2-OG1 3.44Å; N448-T481 PolarHBondContact OD1-N 3.14Å; N448-T481 PolarHBondContact OD1-OG1 3.35Å; T481-T483 PolarHBondContact O-N 2.97Å
482	L	92	Very high	93.1	Very high	73 Å²	73	46.7 Å²	46.7	38%	0.382	23%	0.23	S	C	.	.			trans	-73.4	110.8	178	176.8	60.6	0	0	0	111.3	L476 R479 T486	L476-L482 HydrophobicContact CD2-CD1 3.74Å; R479-L482 HydrophobicContact CB-CB 4.45Å; L482-T486 HydrophobicContact CD1-CG2 4.46Å
483	T	94.1	Very high	93.2	Very high	23 Å²	23	48.8 Å²	48.8	14%	0.141	24%	0.24	C	C	.	.			trans	-94.5	160.6	177.4	75.4	0	0	0	0	112.6	P387 T481 F485 T486 R487	P387-T483 HydrophobicContact CB-CG2 3.9Å; P387-T483 HydrophobicContact CG-CG2 3.91Å; T481-T483 PolarHBondContact O-N 2.97Å; T483-F485 VanDerWaalsContact C-N 3.28Å; T483-F485 PolarHBondContact O-N 2.93Å; T483-T486 PolarHBondContact O-N 3.41Å; T483-T486 PolarHBondContact OG1-N 3.02Å; T483-T486 PolarHBondContact OG1-OG1 2.96Å; T483-R487 PolarHBondContact O-N 3.42Å; T483-R487 VanDerWaalsContact O-N 3.14Å
484	P	95.1	Very high	93.4	Very high	79 Å²	79	45.1 Å²	45.1	51%	0.513	23%	0.226	S	C	.	.	H	α-helix	trans	-59.6	-37.5	171.7	-23.2	34.5	0	0	0	112.9	P384 R487 K488	P384-P484 HydrophobicContact CB-CB 4.12Å; P484-R487 PolarHBondContact O-N 3.17Å; P484-K488 PolarHBondContact O-N 3.24Å
485	F	96.3	Very high	93.6	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-58.4	-53.5	173.3	163.6	-95.3	0	0	0	111.2	T284 M287 L288 P384 L385 L386 P387 F443 V449 T483 R487 K488 L489	T284-F485 HydrophobicContact CG2-CD2 3.82Å; T284-F485 HydrophobicContact CG2-CE2 3.91Å; M287-F485 HydrophobicContact CE-CE2 4.06Å; M287-F485 HydrophobicContact CE-CZ 3.62Å; L288-F485 HydrophobicContact CD1-CD2 4.11Å; L288-F485 HydrophobicContact CD2-CD2 4.13Å; L288-F485 HydrophobicContact CD2-CE2 4.28Å; L288-F485 HydrophobicContact CG-CD2 4.29Å; L288-F485 HydrophobicContact CG-CE2 4.42Å; P384-F485 HydrophobicContact CB-CB 4.25Å; P384-F485 HydrophobicContact CG-CB 4.16Å; L385-F485 WeakPolarHBondContact O-CB 3.37Å; L386-F485 HydrophobicContact CD2-CD1 4.35Å; L386-F485 HydrophobicContact CD2-CD2 3.75Å; L386-F485 HydrophobicContact CD2-CE1 4.03Å; L386-F485 HydrophobicContact CD2-CE2 3.41Å; L386-F485 VanDerWaalsContact CD2-CE2 3.41Å; L386-F485 HydrophobicContact CD2-CG 4.2Å; L386-F485 HydrophobicContact CD2-CZ 3.53Å; P387-F485 HydrophobicContact CG-CD1 4.02Å; P387-F485 HydrophobicContact CG-CE1 4.45Å; F443-F485 HydrophobicContact CE1-CZ 4.31Å; F443-F485 HydrophobicContact CZ-CE1 4.04Å; F443-F485 HydrophobicContact CZ-CZ 4.07Å; V449-F485 HydrophobicContact CG1-CE1 4.27Å; V449-F485 HydrophobicContact CG2-CE1 4.4Å; T483-F485 VanDerWaalsContact C-N 3.28Å; T483-F485 PolarHBondContact O-N 2.93Å; F485-R487 PolarHBondContact O-N 2.9Å; F485-K488 PolarHBondContact O-N 3.16Å; F485-K488 VanDerWaalsContact O-N 3.15Å; F485-L489 HydrophobicContact CE1-CD2 3.89Å; F485-L489 HydrophobicContact CZ-CD2 3.81Å; F485-L489 WeakPolarHBondContact O-CB 3.17Å; F485-L489 PolarHBondContact O-N 3.1Å
486	T	95.9	Very high	93.5	Very high	1 Å²	1	47.2 Å²	47.2	1%	0.006	24%	0.235	C	C	.	.	H	α-helix	trans	-59.5	-36.2	-179.2	-46.8	0	0	0	0	111.9	N448 F475 R479 L482 T483 A490	N448-T486 WeakPolarHBondContact O-CG2 3.34Å; N448-T486 PolarHBondContact O-OG1 3.34Å; F475-T486 HydrophobicContact CE1-CG2 4.34Å; R479-T486 HydrophobicContact CG-CG2 4.29Å; L482-T486 HydrophobicContact CD1-CG2 4.46Å; T483-T486 PolarHBondContact O-N 3.41Å; T483-T486 PolarHBondContact OG1-N 3.02Å; T483-T486 PolarHBondContact OG1-OG1 2.96Å; T486-A490 WeakPolarHBondContact O-CB 3.44Å; T486-A490 PolarHBondContact O-N 3.08Å; T486-A490 VanDerWaalsContact O-N 3.07Å
487	R	95.7	Very high	93.4	Very high	117 Å²	117	47 Å²	47	44%	0.442	23%	0.233	S	C	.	.	H	α-helix	trans	-63.7	-46.4	176.9	-172.8	-177.8	-59.9	133.6	6.9	112.3	L476 T483 P484 F485	L476-R487 HydrophobicContact CD1-CG 4.42Å; T483-R487 PolarHBondContact O-N 3.42Å; T483-R487 VanDerWaalsContact O-N 3.14Å; P484-R487 PolarHBondContact O-N 3.17Å; F485-R487 PolarHBondContact O-N 2.9Å
488	K	95.9	Very high	93.6	Very high	52 Å²	52	41.8 Å²	41.8	23%	0.226	21%	0.211	C	C	.	.	H	α-helix	trans	-71.1	-40.4	177.2	-68.6	-166.8	-176.2	-175.1	0	112.1	L288 E381 P384 P484 F485 A490 E491	L288-K488 HydrophobicContact CD2-CB 3.74Å; E381-K488 IonicContact OE1-NZ 3.36Å; E381-K488 PolarHBondContact OE1-NZ 3.45Å; E381-K488 IonicContact OE2-NZ 3.65Å; E381-K488 PolarHBondContact OE2-NZ 3.35Å; P384-K488 HydrophobicContact CG-CD 4.44Å; P484-K488 PolarHBondContact O-N 3.24Å; F485-K488 PolarHBondContact O-N 3.16Å; F485-K488 VanDerWaalsContact O-N 3.15Å; K488-A490 VanDerWaalsContact C-N 3.27Å; K488-A490 PolarHBondContact O-N 3.22Å; K488-E491 WeakPolarHBondContact O-CA 3.19Å; K488-E491 WeakPolarHBondContact O-CB 3.2Å; K488-E491 PolarHBondContact O-N 2.94Å
489	L	96.3	Very high	93.6	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-57.9	-42.2	177.2	-173.6	66.9	0	0	0	110.8	M287 L288 L316 V449 L450 F485 E491 T492 V495	M287-L489 HydrophobicContact CB-CD1 4.35Å; M287-L489 HydrophobicContact CE-CD1 3.93Å; M287-L489 HydrophobicContact CE-CD2 4.22Å; L288-L489 HydrophobicContact CD2-CB 4.04Å; L288-L489 HydrophobicContact CD2-CD1 4.43Å; L316-L489 HydrophobicContact CD1-CD1 4.4Å; V449-L489 HydrophobicContact CG1-CD2 3.89Å; L450-L489 HydrophobicContact CD1-CD2 4.33Å; L450-L489 HydrophobicContact CD2-CD2 4.06Å; L450-L489 HydrophobicContact CD2-CG 4.43Å; L450-L489 HydrophobicContact CG-CD2 4.07Å; F485-L489 HydrophobicContact CE1-CD2 3.89Å; F485-L489 HydrophobicContact CZ-CD2 3.81Å; F485-L489 WeakPolarHBondContact O-CB 3.17Å; F485-L489 PolarHBondContact O-N 3.1Å; L489-E491 PolarHBondContact O-N 2.9Å; L489-E491 VanDerWaalsContact O-N 3.09Å; L489-T492 WeakPolarHBondContact O-CB 3.32Å; L489-T492 WeakPolarHBondContact O-CG2 3.48Å; L489-T492 PolarHBondContact O-N 3.45Å; L489-T492 VanDerWaalsContact O-N 3.09Å; L489-T492 PolarHBondContact O-OG1 2.98Å; L489-V495 HydrophobicContact CD1-CG2 4.21Å; L489-V495 HydrophobicContact CG-CG2 3.92Å; L489-V495 WeakPolarHBondContact O-CG2 3.18Å
490	A	95.4	Very high	93.5	Very high	4 Å²	4	41.5 Å²	41.5	3%	0.033	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.6	2.7	174.4	0	0	0	0	0	115.2	F470 F475 L476 T486 K488	F470-A490 HydrophobicContact CE1-CB 4.14Å; F470-A490 HydrophobicContact CZ-CB 4.31Å; F475-A490 HydrophobicContact CD1-CB 4.09Å; F475-A490 HydrophobicContact CE1-CB 4.02Å; L476-A490 HydrophobicContact CD2-CB 3.87Å; L476-A490 HydrophobicContact CG-CB 4.45Å; T486-A490 WeakPolarHBondContact O-CB 3.44Å; T486-A490 PolarHBondContact O-N 3.08Å; T486-A490 VanDerWaalsContact O-N 3.07Å; K488-A490 VanDerWaalsContact C-N 3.27Å; K488-A490 PolarHBondContact O-N 3.22Å
491	E	93.9	Very high	93.6	Very high	114 Å²	114	36.7 Å²	36.7	53%	0.533	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	-105.9	-5	172.3	-70.7	168.3	175.1	0	0	112.4	K472 K488 L489	K472-E491 HydrophobicContact CD-CG 4.29Å; K472-E491 VanDerWaalsContact CE-CG 3.44Å; K472-E491 WeakPolarHBondContact CE-OE1 3.42Å; K472-E491 VanDerWaalsContact NZ-CD 3.31Å; K472-E491 IonicContact NZ-OE1 2.82Å; K472-E491 PolarHBondContact NZ-OE1 2.68Å; K488-E491 WeakPolarHBondContact O-CA 3.19Å; K488-E491 WeakPolarHBondContact O-CB 3.2Å; K488-E491 PolarHBondContact O-N 2.94Å; L489-E491 PolarHBondContact O-N 2.9Å; L489-E491 VanDerWaalsContact O-N 3.09Å
492	T	95.2	Very high	93.6	Very high	6 Å²	6	34.1 Å²	34.1	4%	0.037	17%	0.169	C	C	.	.	S	Bend	trans	-80.1	145.6	-174.7	62.9	0	0	0	0	112.8	E289 L489 A494 V495 E496	E289-T492 HydrophobicContact CG-CG2 3.79Å; E289-T492 WeakPolarHBondContact OE1-CB 3.29Å; E289-T492 WeakPolarHBondContact OE2-CA 3.4Å; L489-T492 WeakPolarHBondContact O-CB 3.32Å; L489-T492 WeakPolarHBondContact O-CG2 3.48Å; L489-T492 PolarHBondContact O-N 3.45Å; L489-T492 VanDerWaalsContact O-N 3.09Å; L489-T492 PolarHBondContact O-OG1 2.98Å; T492-A494 PolarHBondContact O-N 3.3Å; T492-V495 PolarHBondContact O-N 3.46Å; T492-V495 VanDerWaalsContact O-N 3.13Å; T492-V495 WeakPolarHBondContact OG1-CG2 3.37Å; T492-V495 PolarHBondContact OG1-N 3.03Å; T492-E496 PolarHBondContact O-N 3.1Å
493	Q	93.1	Very high	93.2	Very high	94 Å²	94	32.1 Å²	32.1	44%	0.439	16%	0.158	S	C	.	.	H	α-helix	trans	-60.5	-33.7	171.2	-165.3	64.3	76.1	0	0	111.4	E289 M319 F320 V495 E496 F497	E289-Q493 VanDerWaalsContact CD-N 3.31Å; E289-Q493 WeakPolarHBondContact OE1-CA 3.26Å; E289-Q493 WeakPolarHBondContact OE1-CB 3.4Å; E289-Q493 PolarHBondContact OE1-N 2.64Å; E289-Q493 PolarHBondContact OE2-N 3.01Å; E289-Q493 VanDerWaalsContact OE2-N 3.07Å; M319-Q493 HydrophobicContact CB-CG 4.48Å; M319-Q493 HydrophobicContact CG-CG 4.21Å; F320-Q493 HydrophobicContact CZ-CB 4.2Å; Q493-V495 VanDerWaalsContact C-N 3.29Å; Q493-V495 PolarHBondContact O-N 3.05Å; Q493-E496 PolarHBondContact NE2-OE2 2.86Å; Q493-E496 PolarHBondContact O-N 2.88Å; Q493-F497 WeakPolarHBondContact O-CB 3.12Å; Q493-F497 PolarHBondContact O-N 2.82Å
494	A	93.4	Very high	92.7	Very high	10 Å²	10	33.9 Å²	33.9	8%	0.083	16%	0.163	C	C	.	.	H	α-helix	trans	-58.7	-35.1	174.3	0	0	0	0	0	113.4	E289 L316 T492 F498	E289-A494 PolarHBondContact OE1-N 3.21Å; L316-A494 HydrophobicContact CD1-CB 4.47Å; T492-A494 PolarHBondContact O-N 3.3Å; A494-F498 VanDerWaalsContact O-CB 3.29Å; A494-F498 WeakPolarHBondContact O-CB 3.46Å; A494-F498 PolarHBondContact O-N 3.18Å
495	V	94.9	Very high	92.3	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-78.1	-37.8	176.5	168.7	0	0	0	0	112.5	L450 I453 F470 L489 T492 Q493 F497 F498 A499	L450-V495 HydrophobicContact CD1-CG2 3.91Å; L450-V495 HydrophobicContact CD2-CG1 4.08Å; L450-V495 HydrophobicContact CD2-CG2 3.78Å; I453-V495 HydrophobicContact CD1-CG1 3.71Å; F470-V495 HydrophobicContact CD1-CG1 4.47Å; F470-V495 HydrophobicContact CE1-CG1 4.05Å; F470-V495 HydrophobicContact CZ-CG1 4.23Å; L489-V495 HydrophobicContact CD1-CG2 4.21Å; L489-V495 HydrophobicContact CG-CG2 3.92Å; L489-V495 WeakPolarHBondContact O-CG2 3.18Å; T492-V495 PolarHBondContact O-N 3.46Å; T492-V495 VanDerWaalsContact O-N 3.13Å; T492-V495 WeakPolarHBondContact OG1-CG2 3.37Å; T492-V495 PolarHBondContact OG1-N 3.03Å; Q493-V495 VanDerWaalsContact C-N 3.29Å; Q493-V495 PolarHBondContact O-N 3.05Å; V495-F497 VanDerWaalsContact C-N 3.32Å; V495-F498 PolarHBondContact O-N 3Å; V495-A499 PolarHBondContact O-N 3.22Å
496	E	89.9	Confident	91.7	Very high	52 Å²	52	34.2 Å²	34.2	24%	0.243	16%	0.159	C	C	.	.	H	α-helix	trans	-59.8	-45.6	170.6	-67.9	-157.4	123.5	0	0	111.2	T492 Q493 F498 A499 E500 R1355	T492-E496 PolarHBondContact O-N 3.1Å; Q493-E496 PolarHBondContact NE2-OE2 2.86Å; Q493-E496 PolarHBondContact O-N 2.88Å; E496-F498 PolarHBondContact O-N 3.49Å; E496-A499 WeakPolarHBondContact O-CB 3.49Å; E496-A499 PolarHBondContact O-N 2.91Å; E496-E500 PolarHBondContact O-N 2.82Å; E496-R1355 IonicContact OE1-CZ 3.85Å; E496-R1355 VanDerWaalsContact OE1-CZ 3.24Å; E496-R1355 IonicContact OE1-NH1 2.7Å; E496-R1355 PolarHBondContact OE1-NH1 2.73Å; E496-R1355 IonicContact OE1-NH2 3.22Å; E496-R1355 PolarHBondContact OE1-NH2 2.87Å; E496-R1355 IonicContact OE2-NH1 3.09Å
497	F	91.3	Very high	91.5	Very high	16 Å²	16	34.5 Å²	34.5	7%	0.07	16%	0.161	C	C	.	.	H	α-helix	trans	-61.9	-43	176.5	-176.7	-83.6	0	0	0	111.9	F2 Q317 M319 Q493 V495 A499 E500 W501	F2-F497 HydrophobicContact CD1-CZ 4.32Å; F2-F497 HydrophobicContact CD2-CE2 4.04Å; F2-F497 HydrophobicContact CE1-CE1 4.44Å; F2-F497 AromaticContact CE1-CE2 3.94Å; F2-F497 HydrophobicContact CE1-CE2 3.94Å; F2-F497 AromaticContact CE1-CZ 3.47Å; F2-F497 HydrophobicContact CE1-CZ 3.47Å; F2-F497 VanDerWaalsContact CE1-CZ 3.47Å; F2-F497 HydrophobicContact CE2-CD2 4.16Å; F2-F497 AromaticContact CE2-CE2 3.24Å; F2-F497 HydrophobicContact CE2-CE2 3.24Å; F2-F497 AromaticContact CE2-CZ 3.71Å; F2-F497 HydrophobicContact CE2-CZ 3.71Å; F2-F497 HydrophobicContact CZ-CD2 4.21Å; F2-F497 HydrophobicContact CZ-CE1 4.11Å; F2-F497 AromaticContact CZ-CE2 3.19Å; F2-F497 HydrophobicContact CZ-CE2 3.19Å; F2-F497 AromaticContact CZ-CZ 3.11Å; F2-F497 HydrophobicContact CZ-CZ 3.11Å; Q317-F497 HydrophobicContact CB-CD1 4.05Å; Q317-F497 HydrophobicContact CB-CE1 3.64Å; Q317-F497 HydrophobicContact CB-CZ 4.31Å; Q317-F497 HydrophobicContact CG-CE1 4.31Å; M319-F497 HydrophobicContact CE-CB 4.41Å; M319-F497 HydrophobicContact CE-CD1 3.81Å; M319-F497 HydrophobicContact CE-CD2 3.5Å; M319-F497 HydrophobicContact CE-CE1 3.85Å; M319-F497 HydrophobicContact CE-CE2 3.48Å; M319-F497 VanDerWaalsContact CE-CE2 3.48Å; M319-F497 HydrophobicContact CE-CG 3.64Å; M319-F497 HydrophobicContact CE-CZ 3.67Å; M319-F497 HydrophobicContact CG-CB 4.46Å; M319-F497 HydrophobicContact SD-CB 4.1Å; M319-F497 HydrophobicContact SD-CD1 4.5Å; M319-F497 HydrophobicContact SD-CD2 3.32Å; M319-F497 WeakPolarHBondContact SD-CD2 3.45Å; M319-F497 HydrophobicContact SD-CE2 3.74Å; M319-F497 HydrophobicContact SD-CG 3.73Å; Q493-F497 WeakPolarHBondContact O-CB 3.12Å; Q493-F497 PolarHBondContact O-N 2.82Å; V495-F497 VanDerWaalsContact C-N 3.32Å; F497-A499 VanDerWaalsContact C-N 3.29Å; F497-A499 PolarHBondContact O-N 3.17Å; F497-E500 PolarHBondContact O-N 2.96Å; F497-E500 VanDerWaalsContact O-N 3.13Å; F497-W501 HydrophobicContact CD1-CB 4.44Å; F497-W501 HydrophobicContact CE1-CB 4.3Å; F497-W501 WeakPolarHBondContact O-CB 3.45Å; F497-W501 PolarHBondContact O-N 3.44Å
498	F	94	Very high	91.3	Very high	1 Å²	1	32.7 Å²	32.7	0%	0.004	16%	0.157	C	C	.	.	H	α-helix	trans	-63.4	-34.7	176.9	177.1	-120.3	0	0	0	112.7	P315 L316 L450 I453 A494 V495 E496 W501 C502 F510	P315-F498 HydrophobicContact CB-CD2 4.24Å; P315-F498 HydrophobicContact CB-CE2 3.68Å; P315-F498 HydrophobicContact CG-CD2 4.15Å; P315-F498 HydrophobicContact CG-CE2 3.42Å; P315-F498 VanDerWaalsContact CG-CE2 3.42Å; P315-F498 HydrophobicContact CG-CZ 3.79Å; L316-F498 HydrophobicContact CD2-CB 3.46Å; L316-F498 VanDerWaalsContact CD2-CB 3.46Å; L316-F498 HydrophobicContact CD2-CD1 3.89Å; L316-F498 HydrophobicContact CD2-CD2 4.16Å; L316-F498 HydrophobicContact CD2-CG 3.57Å; L450-F498 HydrophobicContact CB-CE1 4.38Å; L450-F498 HydrophobicContact CD1-CD1 3.97Å; L450-F498 HydrophobicContact CD1-CE1 4.16Å; I453-F498 HydrophobicContact CD1-CD1 4.17Å; I453-F498 HydrophobicContact CG2-CD1 4.3Å; I453-F498 HydrophobicContact CG2-CE1 3.86Å; A494-F498 VanDerWaalsContact O-CB 3.29Å; A494-F498 WeakPolarHBondContact O-CB 3.46Å; A494-F498 PolarHBondContact O-N 3.18Å; V495-F498 PolarHBondContact O-N 3Å; E496-F498 PolarHBondContact O-N 3.49Å; F498-W501 HydrophobicContact CD2-CE3 4.12Å; F498-W501 HydrophobicContact CE2-CE3 4.05Å; F498-W501 HydrophobicContact CE2-CZ3 4.26Å; F498-W501 PolarHBondContact O-N 2.92Å; F498-C502 WeakPolarHBondContact O-CB 3.29Å; F498-C502 PolarHBondContact O-N 2.76Å; F498-C502 PolarHBondContact O-SG 3.33Å; F498-F510 HydrophobicContact CE2-CE2 4.31Å; F498-F510 HydrophobicContact CE2-CZ 4.22Å; F498-F510 HydrophobicContact CZ-CE2 4.07Å; F498-F510 AromaticContact CZ-CZ 3.81Å; F498-F510 HydrophobicContact CZ-CZ 3.81Å
499	A	91.8	Very high	91.2	Very high	1 Å²	1	30.2 Å²	30.2	1%	0.008	15%	0.146	C	C	.	.	H	α-helix	trans	-63.7	-38.2	172.2	0	0	0	0	0	112.5	I453 T457 V468 V495 E496 F497	I453-A499 HydrophobicContact CD1-CB 4.28Å; T457-A499 HydrophobicContact CG2-CB 3.71Å; V468-A499 HydrophobicContact CG1-CB 4.24Å; V495-A499 PolarHBondContact O-N 3.22Å; E496-A499 WeakPolarHBondContact O-CB 3.49Å; E496-A499 PolarHBondContact O-N 2.91Å; F497-A499 VanDerWaalsContact C-N 3.29Å; F497-A499 PolarHBondContact O-N 3.17Å
500	E	89.7	Confident	91	Very high	37 Å²	37	31 Å²	31	17%	0.173	15%	0.15	C	C	.	.	H	α-helix	trans	-68.3	-47.1	171.9	-68.2	-175	163.1	0	0	111.9	V467 V468 E496 F497 C502 L503	V467-E500 WeakPolarHBondContact CA-OE1 3.36Å; V468-E500 HydrophobicContact CB-CG 3.7Å; V468-E500 HydrophobicContact CG2-CB 4.4Å; V468-E500 HydrophobicContact CG2-CG 3.92Å; V468-E500 PolarHBondContact N-OE1 3.2Å; E496-E500 PolarHBondContact O-N 2.82Å; F497-E500 PolarHBondContact O-N 2.96Å; F497-E500 VanDerWaalsContact O-N 3.13Å; E500-C502 PolarHBondContact O-N 2.84Å; E500-L503 WeakPolarHBondContact O-CB 3.39Å; E500-L503 PolarHBondContact O-N 3.12Å
501	W	90.7	Very high	90.8	Very high	12 Å²	12	36 Å²	36	5%	0.045	17%	0.172	C	C	.	.	H	α-helix	trans	-60.3	-30.8	179.2	-172.6	91.5	0	0	0	112.8	Y314 P315 F497 F498 L503 Y504 P505 F510	Y314-W501 HydrophobicContact CE2-CH2 4.21Å; Y314-W501 HydrophobicContact CE2-CZ2 4.31Å; P315-W501 HydrophobicContact CB-CH2 4.3Å; P315-W501 HydrophobicContact CB-CZ3 4.03Å; F497-W501 HydrophobicContact CD1-CB 4.44Å; F497-W501 HydrophobicContact CE1-CB 4.3Å; F497-W501 WeakPolarHBondContact O-CB 3.45Å; F497-W501 PolarHBondContact O-N 3.44Å; F498-W501 HydrophobicContact CD2-CE3 4.12Å; F498-W501 HydrophobicContact CE2-CE3 4.05Å; F498-W501 HydrophobicContact CE2-CZ3 4.26Å; F498-W501 PolarHBondContact O-N 2.92Å; W501-L503 PolarHBondContact O-N 2.86Å; W501-Y504 CarbonylContact O-C 3.59Å; W501-Y504 PolarHBondContact O-N 2.92Å; W501-Y504 VanDerWaalsContact O-N 3.17Å; W501-P505 HydrophobicContact CD2-CB 4.32Å; W501-P505 HydrophobicContact CE3-CB 4.25Å; W501-P505 HydrophobicContact CE3-CG 4.36Å; W501-P505 HydrophobicContact CH2-CB 3.73Å; W501-P505 HydrophobicContact CH2-CG 4.47Å; W501-P505 HydrophobicContact CZ2-CB 3.78Å; W501-P505 HydrophobicContact CZ3-CB 3.97Å; W501-P505 HydrophobicContact CZ3-CG 4.23Å; W501-P505 WeakPolarHBondContact O-CA 3.35Å; W501-P505 WeakPolarHBondContact O-CD 3.41Å; W501-P505 WeakPolarHBondContact O-CG 3.39Å; W501-F510 HydrophobicContact CH2-CB 3.72Å; W501-F510 HydrophobicContact CH2-CG 4.2Å; W501-F510 HydrophobicContact CZ3-CB 3.88Å; W501-F510 AromaticContact CZ3-CD1 3.97Å; W501-F510 HydrophobicContact CZ3-CD1 3.97Å; W501-F510 HydrophobicContact CZ3-CD2 4.46Å; W501-F510 AromaticContact CZ3-CG 3.85Å; W501-F510 HydrophobicContact CZ3-CG 3.85Å
502	C	90.2	Very high	90.8	Very high	24 Å²	24	33.7 Å²	33.7	16%	0.162	16%	0.159	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-20.3	175.1	-76.6	0	0	0	0	114.3	T454 F498 E500	T454-C502 HydrophobicContact CG2-CB 3.77Å; F498-C502 WeakPolarHBondContact O-CB 3.29Å; F498-C502 PolarHBondContact O-N 2.76Å; F498-C502 PolarHBondContact O-SG 3.33Å; E500-C502 PolarHBondContact O-N 2.84Å
503	L	85	Confident	90.7	Very high	31 Å²	31	34.2 Å²	34.2	16%	0.162	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.6	-35.9	172.9	-68.5	-175.9	0	0	0	112.8	T459 L462 P466 V468 E500 W501	T459-L503 HydrophobicContact CG2-CD1 4.06Å; L462-L503 HydrophobicContact CD2-CD1 4.26Å; P466-L503 HydrophobicContact CB-CD1 4.25Å; V468-L503 HydrophobicContact CG2-CD1 3.36Å; V468-L503 HydrophobicContact CG2-CG 3.99Å; E500-L503 WeakPolarHBondContact O-CB 3.39Å; E500-L503 PolarHBondContact O-N 3.12Å; W501-L503 PolarHBondContact O-N 2.86Å
504	Y	83.5	Confident	90.5	Very high	60 Å²	60	34.9 Å²	34.9	24%	0.235	16%	0.164	C	C	.	.	S	Bend	trans	-141.4	78.6	179.9	-164.8	-97.3	0	0	0	111	K257 W501 T1299 L1302 E1303	K257-Y504 PolarHBondContact NZ-OH 3.45Å; W501-Y504 CarbonylContact O-C 3.59Å; W501-Y504 PolarHBondContact O-N 2.92Å; W501-Y504 VanDerWaalsContact O-N 3.17Å; Y504-T1299 HydrophobicContact CD2-CG2 3.79Å; Y504-T1299 HydrophobicContact CE2-CG2 3.59Å; Y504-L1302 HydrophobicContact CD2-CB 4.14Å; Y504-L1302 HydrophobicContact CD2-CD1 3.53Å; Y504-L1302 HydrophobicContact CD2-CG 4.49Å; Y504-L1302 HydrophobicContact CE2-CB 4.15Å; Y504-L1302 HydrophobicContact CE2-CD1 4.37Å; Y504-L1302 HydrophobicContact CG-CD1 3.76Å; Y504-E1303 HydrophobicContact CE2-CG 4.28Å; Y504-E1303 PolarHBondContact OH-OE1 2.99Å
505	P	87.2	Confident	90.5	Very high	21 Å²	21	38.4 Å²	38.4	14%	0.136	19%	0.194	C	C	.	.			trans	-61.9	138.1	177.2	-26.5	37.3	0	0	0	112.2	W501 N507	W501-P505 HydrophobicContact CD2-CB 4.32Å; W501-P505 HydrophobicContact CE3-CB 4.25Å; W501-P505 HydrophobicContact CE3-CG 4.36Å; W501-P505 HydrophobicContact CH2-CB 3.73Å; W501-P505 HydrophobicContact CH2-CG 4.47Å; W501-P505 HydrophobicContact CZ2-CB 3.78Å; W501-P505 HydrophobicContact CZ3-CB 3.97Å; W501-P505 HydrophobicContact CZ3-CG 4.23Å; W501-P505 WeakPolarHBondContact O-CA 3.35Å; W501-P505 WeakPolarHBondContact O-CD 3.41Å; W501-P505 WeakPolarHBondContact O-CG 3.39Å; P505-N507 WeakPolarHBondContact CB-O 3.15Å; P505-N507 PolarHBondContact O-N 3.22Å
506	E	83.4	Confident	90.4	Very high	65 Å²	65	40.6 Å²	40.6	30%	0.304	22%	0.216	S	C	.	.	S	Bend	trans	-63.4	-22.6	175.7	-66.9	-176.7	165.7	0	0	113.3
507	N	90.7	Very high	90.6	Very high	8 Å²	8	40 Å²	40	4%	0.043	22%	0.216	C	C	.	.	S	Bend	trans	-145.6	157.6	175.9	71.5	71.9	0	0	0	111.6	K257 Y314 P505 V509	K257-N507 CarbonylContact O-C 3.56Å; K257-N507 VanDerWaalsContact O-CA 3.26Å; K257-N507 WeakPolarHBondContact O-CA 3.31Å; K257-N507 WeakPolarHBondContact O-CB 3.21Å; Y314-N507 PolarHBondContact OH-OD1 3.38Å; P505-N507 WeakPolarHBondContact CB-O 3.15Å; P505-N507 PolarHBondContact O-N 3.22Å; N507-V509 VanDerWaalsContact C-N 3.29Å; N507-V509 PolarHBondContact O-N 3.44Å; N507-V509 VanDerWaalsContact OD1-CB 3.26Å; N507-V509 WeakPolarHBondContact OD1-CB 3.33Å; N507-V509 PolarHBondContact OD1-N 3.4Å
508	E	91.4	Very high	90.6	Very high	78 Å²	78	44.3 Å²	44.3	36%	0.364	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.6	-11.9	-179.6	-62.8	175.7	-160	0	0	113.6	K257 F510 Q511 R512	K257-E508 PolarHBondContact O-N 2.9Å; E508-F510 VanDerWaalsContact C-N 3.29Å; E508-F510 PolarHBondContact O-N 3.12Å; E508-Q511 WeakPolarHBondContact O-CA 3.42Å; E508-Q511 WeakPolarHBondContact O-CB 3.47Å; E508-Q511 PolarHBondContact O-N 2.85Å; E508-R512 HydrophobicContact CB-CG 4.3Å; E508-R512 WeakPolarHBondContact O-CG 3.26Å; E508-R512 PolarHBondContact O-N 3.17Å; E508-R512 IonicContact OE2-CZ 3.73Å; E508-R512 IonicContact OE2-NE 3.43Å; E508-R512 PolarHBondContact OE2-NE 3.21Å; E508-R512 IonicContact OE2-NH2 2.77Å; E508-R512 PolarHBondContact OE2-NH2 3.35Å
509	V	94.4	Very high	90.5	Very high	0 Å²	0	47 Å²	47	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-64.6	-34.4	-166.9	178.4	0	0	0	0	112.4	T258 R259 L260 N507 Q511 R512 I513 I523	T258-V509 WeakPolarHBondContact O-CG2 3.33Å; R259-V509 VanDerWaalsContact CA-CG2 3.48Å; L260-V509 HydrophobicContact CD2-CB 3.96Å; L260-V509 HydrophobicContact CD2-CG1 3.62Å; L260-V509 HydrophobicContact CD2-CG2 4.37Å; L260-V509 HydrophobicContact CG-CB 4.27Å; L260-V509 HydrophobicContact CG-CG1 3.85Å; L260-V509 HydrophobicContact CG-CG2 4.18Å; N507-V509 VanDerWaalsContact C-N 3.29Å; N507-V509 PolarHBondContact O-N 3.44Å; N507-V509 VanDerWaalsContact OD1-CB 3.26Å; N507-V509 WeakPolarHBondContact OD1-CB 3.33Å; N507-V509 PolarHBondContact OD1-N 3.4Å; V509-Q511 VanDerWaalsContact C-N 3.29Å; V509-Q511 PolarHBondContact O-N 3.5Å; V509-R512 PolarHBondContact O-N 2.94Å; V509-I513 HydrophobicContact CG1-CD1 3.67Å; V509-I513 HydrophobicContact CG1-CG1 3.98Å; V509-I513 WeakPolarHBondContact O-CB 3.47Å; V509-I513 VanDerWaalsContact O-CG1 3.29Å; V509-I513 WeakPolarHBondContact O-CG1 3.29Å; V509-I513 PolarHBondContact O-N 3.37Å; V509-I523 HydrophobicContact CG1-CB 3.8Å; V509-I523 HydrophobicContact CG1-CD1 3.83Å; V509-I523 HydrophobicContact CG1-CG1 4.43Å; V509-I523 HydrophobicContact CG1-CG2 3.99Å; V509-I523 HydrophobicContact CG2-CB 4Å; V509-I523 HydrophobicContact CG2-CG2 4.13Å
510	F	92.3	Very high	90.6	Very high	17 Å²	17	48.1 Å²	48.1	8%	0.075	26%	0.257	C	S	.	.	H	α-helix	trans	-57	-44.4	173.3	178.2	-105.7	0	0	0	111.8	Y314 P315 V441 N445 F498 W501 E508 H514	Y314-F510 PolarHBondContact OH-N 3.02Å; Y314-F510 VanDerWaalsContact OH-N 3.13Å; P315-F510 HydrophobicContact CB-CD2 3.81Å; P315-F510 HydrophobicContact CB-CE2 4.17Å; P315-F510 HydrophobicContact CG-CD2 3.86Å; P315-F510 HydrophobicContact CG-CE2 3.74Å; V441-F510 HydrophobicContact CG1-CD2 3.85Å; V441-F510 HydrophobicContact CG1-CE2 4.06Å; N445-F510 WeakPolarHBondContact ND2-CE2 3.28Å; N445-F510 WeakPolarHBondContact OD1-CE2 3.5Å; N445-F510 WeakPolarHBondContact OD1-CZ 3.36Å; F498-F510 HydrophobicContact CE2-CE2 4.31Å; F498-F510 HydrophobicContact CE2-CZ 4.22Å; F498-F510 HydrophobicContact CZ-CE2 4.07Å; F498-F510 AromaticContact CZ-CZ 3.81Å; F498-F510 HydrophobicContact CZ-CZ 3.81Å; W501-F510 HydrophobicContact CH2-CB 3.72Å; W501-F510 HydrophobicContact CH2-CG 4.2Å; W501-F510 HydrophobicContact CZ3-CB 3.88Å; W501-F510 AromaticContact CZ3-CD1 3.97Å; W501-F510 HydrophobicContact CZ3-CD1 3.97Å; W501-F510 HydrophobicContact CZ3-CD2 4.46Å; W501-F510 AromaticContact CZ3-CG 3.85Å; W501-F510 HydrophobicContact CZ3-CG 3.85Å; E508-F510 VanDerWaalsContact C-N 3.29Å; E508-F510 PolarHBondContact O-N 3.12Å; F510-H514 AromaticContact CE1-CD2 3.66Å; F510-H514 AromaticContact CE1-NE2 3.51Å; F510-H514 AromaticContact CE2-NE2 3.77Å; F510-H514 AromaticContact CZ-CD2 3.69Å; F510-H514 AromaticContact CZ-NE2 3.17Å; F510-H514 WeakPolarHBondContact CZ-NE2 3.36Å; F510-H514 PolarHBondContact O-CD2 2.95Å; F510-H514 VanDerWaalsContact O-CD2 3.29Å; F510-H514 PolarHBondContact O-N 3.32Å; F510-H514 VanDerWaalsContact O-N 3.17Å
511	Q	90.6	Very high	90.7	Very high	108 Å²	108	51.1 Å²	51.1	51%	0.505	27%	0.271	S	S	.	.	H	α-helix	trans	-70.4	-38.4	176.6	-58.9	179.2	-0.7	0	0	111.9	E508 V509 H514 A515	E508-Q511 WeakPolarHBondContact O-CA 3.42Å; E508-Q511 WeakPolarHBondContact O-CB 3.47Å; E508-Q511 PolarHBondContact O-N 2.85Å; V509-Q511 VanDerWaalsContact C-N 3.29Å; V509-Q511 PolarHBondContact O-N 3.5Å; Q511-H514 WeakPolarHBondContact O-CB 3.5Å; Q511-H514 PolarHBondContact O-N 3.18Å; Q511-A515 PolarHBondContact O-N 3.24Å
512	R	94.4	Very high	90.8	Very high	67 Å²	67	55.1 Å²	55.1	25%	0.253	29%	0.291	S	S	.	.	H	α-helix	trans	-63.7	-39.8	175.9	-68.4	173.5	174.6	-138.1	-8.9	112.2	T258 E508 V509 A515 G516 V517 I523	T258-R512 PolarHBondContact O-NH1 2.96Å; E508-R512 HydrophobicContact CB-CG 4.3Å; E508-R512 WeakPolarHBondContact O-CG 3.26Å; E508-R512 PolarHBondContact O-N 3.17Å; E508-R512 IonicContact OE2-CZ 3.73Å; E508-R512 IonicContact OE2-NE 3.43Å; E508-R512 PolarHBondContact OE2-NE 3.21Å; E508-R512 IonicContact OE2-NH2 2.77Å; E508-R512 PolarHBondContact OE2-NH2 3.35Å; V509-R512 PolarHBondContact O-N 2.94Å; R512-A515 CarbonylContact O-C 3.56Å; R512-A515 WeakPolarHBondContact O-CA 3.38Å; R512-A515 WeakPolarHBondContact O-CB 3.37Å; R512-A515 PolarHBondContact O-N 3.31Å; R512-A515 VanDerWaalsContact O-N 3.14Å; R512-G516 PolarHBondContact O-N 3.45Å; R512-G516 VanDerWaalsContact O-N 3.13Å; R512-V517 HydrophobicContact CB-CB 4.15Å; R512-V517 WeakPolarHBondContact O-CB 3.49Å; R512-V517 PolarHBondContact O-N 3.06Å; R512-I523 HydrophobicContact CB-CG2 4.18Å
513	I	93.7	Very high	91	Very high	16 Å²	16	54 Å²	54	8%	0.082	28%	0.283	C	S	.	.	H	α-helix	trans	-64.2	-40.6	173.2	-67.9	165.7	0	0	0	110.7	V438 V441 V509 A515 G516 V517 I523	V438-I513 HydrophobicContact CG1-CG2 4.38Å; V438-I513 HydrophobicContact CG2-CD1 3.9Å; V438-I513 HydrophobicContact CG2-CG1 4.23Å; V441-I513 HydrophobicContact CB-CD1 4.13Å; V441-I513 HydrophobicContact CB-CG2 4.32Å; V441-I513 HydrophobicContact CG1-CB 4.15Å; V441-I513 HydrophobicContact CG1-CD1 4.09Å; V441-I513 HydrophobicContact CG1-CG2 3.66Å; V441-I513 HydrophobicContact CG2-CD1 3.96Å; V509-I513 HydrophobicContact CG1-CD1 3.67Å; V509-I513 HydrophobicContact CG1-CG1 3.98Å; V509-I513 WeakPolarHBondContact O-CB 3.47Å; V509-I513 VanDerWaalsContact O-CG1 3.29Å; V509-I513 WeakPolarHBondContact O-CG1 3.29Å; V509-I513 PolarHBondContact O-N 3.37Å; I513-A515 VanDerWaalsContact C-N 3.3Å; I513-A515 PolarHBondContact O-N 3.49Å; I513-G516 WeakPolarHBondContact O-CA 3.45Å; I513-G516 PolarHBondContact O-N 2.83Å; I513-V517 WeakPolarHBondContact CA-O 3.26Å; I513-I523 HydrophobicContact CD1-CD1 4.4Å; I513-I523 HydrophobicContact CG1-CD1 4.19Å
514	H	88.6	Confident	91.5	Very high	109 Å²	109	52.5 Å²	52.5	51%	0.505	28%	0.275	S	S	.	.	H	α-helix	trans	-60.7	-36.8	171	-87.4	-71.4	0	0	0	113.1	N445 F510 Q511 G516	N445-H514 PolarHBondContact ND2-CE1 3.14Å; N445-H514 PolarHBondContact ND2-NE2 2.85Å; N445-H514 PolarHBondContact OD1-NE2 2.95Å; F510-H514 AromaticContact CE1-CD2 3.66Å; F510-H514 AromaticContact CE1-NE2 3.51Å; F510-H514 AromaticContact CE2-NE2 3.77Å; F510-H514 AromaticContact CZ-CD2 3.69Å; F510-H514 AromaticContact CZ-NE2 3.17Å; F510-H514 WeakPolarHBondContact CZ-NE2 3.36Å; F510-H514 PolarHBondContact O-CD2 2.95Å; F510-H514 VanDerWaalsContact O-CD2 3.29Å; F510-H514 PolarHBondContact O-N 3.32Å; F510-H514 VanDerWaalsContact O-N 3.17Å; Q511-H514 WeakPolarHBondContact O-CB 3.5Å; Q511-H514 PolarHBondContact O-N 3.18Å; H514-G516 PolarHBondContact O-N 2.91Å
515	A	92.6	Very high	92	Very high	84 Å²	84	49.7 Å²	49.7	69%	0.694	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.7	-3.5	172.7	0	0	0	0	0	113.8	Q511 R512 I513	Q511-A515 PolarHBondContact O-N 3.24Å; R512-A515 CarbonylContact O-C 3.56Å; R512-A515 WeakPolarHBondContact O-CA 3.38Å; R512-A515 WeakPolarHBondContact O-CB 3.37Å; R512-A515 PolarHBondContact O-N 3.31Å; R512-A515 VanDerWaalsContact O-N 3.14Å; I513-A515 VanDerWaalsContact C-N 3.3Å; I513-A515 PolarHBondContact O-N 3.49Å
516	G	93	Very high	92.2	Very high	46 Å²	46	49.5 Å²	49.5	47%	0.474	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	93.8	2.1	177.9	0	0	0	0	0	115.1	R512 I513 H514 H518	R512-G516 PolarHBondContact O-N 3.45Å; R512-G516 VanDerWaalsContact O-N 3.13Å; I513-G516 WeakPolarHBondContact O-CA 3.45Å; I513-G516 PolarHBondContact O-N 2.83Å; H514-G516 PolarHBondContact O-N 2.91Å; G516-H518 PolarHBondContact O-ND1 3.49Å
517	V	93.7	Very high	92.6	Very high	40 Å²	40	46.8 Å²	46.8	24%	0.242	25%	0.251	C	S	.	.			trans	-79.1	120.9	177.2	-175.4	0	0	0	0	109.9	R512 I513 Q522 I523	R512-V517 HydrophobicContact CB-CB 4.15Å; R512-V517 WeakPolarHBondContact O-CB 3.49Å; R512-V517 PolarHBondContact O-N 3.06Å; I513-V517 WeakPolarHBondContact CA-O 3.26Å; V517-Q522 HydrophobicContact CG1-CB 4.02Å; V517-I523 HydrophobicContact CG1-CG2 3.92Å
518	H	91.9	Very high	92.5	Very high	105 Å²	105	50.1 Å²	50.1	49%	0.486	27%	0.268	S	S	.	.			trans	-141.2	10.7	-178.1	56.1	-81.8	0	0	0	113.1	V438 G516	V438-H518 HydrophobicContact CG1-CB 3.99Å; V438-H518 HydrophobicContact CG2-CB 4.23Å; G516-H518 PolarHBondContact O-ND1 3.49Å
519	D	92.2	Very high	92.5	Very high	59 Å²	59	47.7 Å²	47.7	32%	0.316	26%	0.255	S	S	.	.			trans	-73.8	122	179.5	176.3	5.8	0	0	0	110.7	E521 Q522 I523	D519-E521 PolarHBondContact O-N 3.49Å; D519-E521 VanDerWaalsContact O-N 3.16Å; D519-E521 PolarHBondContact OD1-N 3.35Å; D519-Q522 HydrophobicContact CB-CB 4.39Å; D519-Q522 HydrophobicContact CB-CG 4.25Å; D519-Q522 PolarHBondContact O-N 3.03Å; D519-Q522 PolarHBondContact OD2-NE2 3.45Å; D519-I523 VanDerWaalsContact O-CG1 3.28Å; D519-I523 WeakPolarHBondContact O-CG1 3.44Å; D519-I523 PolarHBondContact O-N 3.04Å
520	P	92.5	Very high	92.4	Very high	23 Å²	23	48.2 Å²	48.2	15%	0.149	26%	0.257	C	S	.	.	H	α-helix	trans	-54.2	-30.7	176.1	-24.9	34	0	0	0	113.9	V434 Q522 G524 W529	V434-P520 HydrophobicContact CB-CG 4.35Å; V434-P520 HydrophobicContact CG1-CB 4.4Å; V434-P520 HydrophobicContact CG1-CG 4.18Å; V434-P520 HydrophobicContact CG2-CB 4.42Å; P520-Q522 PolarHBondContact O-N 2.91Å; P520-G524 WeakPolarHBondContact O-CA 3.39Å; P520-G524 PolarHBondContact O-N 2.96Å; P520-W529 HydrophobicContact CB-CD2 4.22Å; P520-W529 HydrophobicContact CB-CH2 4.04Å; P520-W529 HydrophobicContact CB-CZ2 3.55Å
521	E	92.7	Very high	92.4	Very high	100 Å²	100	48.9 Å²	48.9	47%	0.467	26%	0.261	S	S	.	.	H	α-helix	trans	-66.4	-29.1	178	-62.9	-168.9	172.8	0	0	111.8	R259 R427 D519	R259-E521 VanDerWaalsContact CZ-O 3.3Å; R259-E521 PolarHBondContact NH1-O 3.32Å; R259-E521 PolarHBondContact NH2-O 3.12Å; R427-E521 IonicContact NH2-OE1 2.7Å; R427-E521 PolarHBondContact NH2-OE1 3.33Å; D519-E521 PolarHBondContact O-N 3.49Å; D519-E521 VanDerWaalsContact O-N 3.16Å; D519-E521 PolarHBondContact OD1-N 3.35Å
522	Q	93	Very high	92.3	Very high	97 Å²	97	49.4 Å²	49.4	45%	0.453	27%	0.267	S	S	.	.	H	α-helix	trans	-94.7	-39.5	-178.8	-61.6	-177.8	35.4	0	0	114.4	V517 D519 P520	V517-Q522 HydrophobicContact CG1-CB 4.02Å; D519-Q522 HydrophobicContact CB-CB 4.39Å; D519-Q522 HydrophobicContact CB-CG 4.25Å; D519-Q522 PolarHBondContact O-N 3.03Å; D519-Q522 PolarHBondContact OD2-NE2 3.45Å; P520-Q522 PolarHBondContact O-N 2.91Å
523	I	95.1	Very high	92.1	Very high	0 Å²	0	53.2 Å²	53.2	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-113.4	-11.4	-174.5	60.2	156.3	0	0	0	114.4	L260 V434 V438 V509 R512 I513 V517 D519	L260-I523 WeakPolarHBondContact CG-O 3.26Å; L260-I523 PolarHBondContact N-O 2.95Å; V434-I523 HydrophobicContact CG1-CD1 4.11Å; V434-I523 HydrophobicContact CG1-CG1 4.3Å; V438-I523 HydrophobicContact CG2-CD1 3.86Å; V509-I523 HydrophobicContact CG1-CB 3.8Å; V509-I523 HydrophobicContact CG1-CD1 3.83Å; V509-I523 HydrophobicContact CG1-CG1 4.43Å; V509-I523 HydrophobicContact CG1-CG2 3.99Å; V509-I523 HydrophobicContact CG2-CB 4Å; V509-I523 HydrophobicContact CG2-CG2 4.13Å; R512-I523 HydrophobicContact CB-CG2 4.18Å; I513-I523 HydrophobicContact CD1-CD1 4.4Å; I513-I523 HydrophobicContact CG1-CD1 4.19Å; V517-I523 HydrophobicContact CG1-CG2 3.92Å; D519-I523 VanDerWaalsContact O-CG1 3.28Å; D519-I523 WeakPolarHBondContact O-CG1 3.44Å; D519-I523 PolarHBondContact O-N 3.04Å
524	G	94.2	Very high	92	Very high	0 Å²	0	53.2 Å²	53.2	0%	0	29%	0.292	C	S	.	.			trans	-69.8	150.6	-175.4	0	0	0	0	0	113.7	R259 P520 W529	R259-G524 WeakPolarHBondContact CD-O 3.45Å; R259-G524 PolarHBondContact NH1-O 2.79Å; P520-G524 WeakPolarHBondContact O-CA 3.39Å; P520-G524 PolarHBondContact O-N 2.96Å; G524-W529 VanDerWaalsContact C-CE3 3.42Å; G524-W529 VanDerWaalsContact CA-CE3 3.42Å; G524-W529 VanDerWaalsContact CA-CZ3 3.42Å
525	D	94.2	Very high	92.2	Very high	0 Å²	0	50 Å²	50	0%	0	29%	0.285	C	S	.	.			trans	-87	-20.4	-172.8	64.4	-58.8	0	0	0	115	P255 L260 T261 I263 R437 Y530	P255-D525 HydrophobicContact CG-CB 4.44Å; L260-D525 HydrophobicContact CB-CB 4.1Å; L260-D525 VanDerWaalsContact O-CB 3.23Å; L260-D525 WeakPolarHBondContact O-CB 3.34Å; T261-D525 VanDerWaalsContact O-CB 3.31Å; T261-D525 WeakPolarHBondContact O-CB 3.24Å; I263-D525 PolarHBondContact N-OD2 2.72Å; R437-D525 IonicContact CZ-OD1 2.73Å; R437-D525 IonicContact NH1-OD1 3.39Å; R437-D525 IonicContact NH2-OD1 2.76Å; R437-D525 PolarHBondContact NH2-OD1 2.93Å; D525-Y530 WeakPolarHBondContact O-CE1 3.34Å; D525-Y530 PolarHBondContact O-OH 3.3Å
526	K	92.7	Very high	92.2	Very high	17 Å²	17	49.8 Å²	49.8	7%	0.074	27%	0.27	C	S	.	.	S	Bend	trans	-79.4	133.3	-173.9	-55.1	-64.7	-171.9	-63.7	0	112.1	I263 D430 I528 W529 Y530	I263-K526 WeakPolarHBondContact O-CE 3.41Å; I263-K526 PolarHBondContact O-NZ 2.7Å; D430-K526 HydrophobicContact CB-CG 4.04Å; D430-K526 WeakPolarHBondContact OD1-CE 3.46Å; D430-K526 IonicContact OD1-NZ 3.45Å; K526-I528 HydrophobicContact CB-CD1 4.45Å; K526-I528 HydrophobicContact CB-CG1 3.91Å; K526-I528 PolarHBondContact O-N 3.16Å; K526-W529 HydrophobicContact CB-CD2 4.28Å; K526-W529 HydrophobicContact CB-CE3 3.6Å; K526-W529 HydrophobicContact CB-CH2 4.16Å; K526-W529 HydrophobicContact CB-CZ3 3.54Å; K526-W529 HydrophobicContact CG-CE3 4.14Å; K526-W529 HydrophobicContact CG-CH2 3.88Å; K526-W529 HydrophobicContact CG-CZ3 3.52Å; K526-W529 VanDerWaalsContact N-CE3 3.33Å; K526-W529 PolarHBondContact O-N 3.09Å; K526-Y530 WeakPolarHBondContact O-CD1 3.08Å; K526-Y530 WeakPolarHBondContact O-CE1 3.38Å
527	G	90.1	Very high	92.1	Very high	8 Å²	8	48.6 Å²	48.6	8%	0.082	25%	0.252	C	S	.	.	G	3₁₀ helix	trans	-53.2	-28.3	-177.9	0	0	0	0	0	115.1	W529 Y530 Q531	G527-W529 PolarHBondContact O-N 3.11Å; G527-Y530 PolarHBondContact O-N 3.25Å; G527-Y530 VanDerWaalsContact O-N 3.09Å; G527-Q531 WeakPolarHBondContact O-CB 3.48Å; G527-Q531 VanDerWaalsContact O-CG 3.27Å; G527-Q531 WeakPolarHBondContact O-CG 3.35Å; G527-Q531 PolarHBondContact O-N 2.88Å
528	I	89.6	Confident	92	Very high	79 Å²	79	51.8 Å²	51.8	41%	0.405	27%	0.268	S	S	.	.	G	3₁₀ helix	trans	-55.1	-22.3	176.3	62.4	173.7	0	0	0	114	R427 K526	R427-I528 HydrophobicContact CB-CD1 4.49Å; R427-I528 HydrophobicContact CG-CD1 4.14Å; K526-I528 HydrophobicContact CB-CD1 4.45Å; K526-I528 HydrophobicContact CB-CG1 3.91Å; K526-I528 PolarHBondContact O-N 3.16Å
529	W	91.1	Very high	92	Very high	26 Å²	26	49.2 Å²	49.2	10%	0.098	26%	0.255	C	S	.	.	G	3₁₀ helix	trans	-94.1	-9.2	-178.2	-65	-46.8	0	0	0	114.8	D430 V434 P520 G524 K526 G527	D430-W529 HydrophobicContact CB-CH2 3.72Å; D430-W529 HydrophobicContact CB-CZ2 3.82Å; V434-W529 HydrophobicContact CG2-CH2 3.56Å; V434-W529 HydrophobicContact CG2-CZ3 3.8Å; P520-W529 HydrophobicContact CB-CD2 4.22Å; P520-W529 HydrophobicContact CB-CH2 4.04Å; P520-W529 HydrophobicContact CB-CZ2 3.55Å; G524-W529 VanDerWaalsContact C-CE3 3.42Å; G524-W529 VanDerWaalsContact CA-CE3 3.42Å; G524-W529 VanDerWaalsContact CA-CZ3 3.42Å; K526-W529 HydrophobicContact CB-CD2 4.28Å; K526-W529 HydrophobicContact CB-CE3 3.6Å; K526-W529 HydrophobicContact CB-CH2 4.16Å; K526-W529 HydrophobicContact CB-CZ3 3.54Å; K526-W529 HydrophobicContact CG-CE3 4.14Å; K526-W529 HydrophobicContact CG-CH2 3.88Å; K526-W529 HydrophobicContact CG-CZ3 3.52Å; K526-W529 VanDerWaalsContact N-CE3 3.33Å; K526-W529 PolarHBondContact O-N 3.09Å; G527-W529 PolarHBondContact O-N 3.11Å
530	Y	93.3	Very high	92	Very high	11 Å²	11	52.6 Å²	52.6	4%	0.043	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-147.8	-7.7	-174.1	57.7	-93.2	0	0	0	115.9	A253 L254 P255 D525 K526 G527 D532 N533 L534	A253-Y530 HydrophobicContact CB-CE2 3.84Å; L254-Y530 VanDerWaalsContact C-OH 3.31Å; P255-Y530 WeakPolarHBondContact CD-OH 3.34Å; P255-Y530 VanDerWaalsContact N-OH 3.1Å; D525-Y530 WeakPolarHBondContact O-CE1 3.34Å; D525-Y530 PolarHBondContact O-OH 3.3Å; K526-Y530 WeakPolarHBondContact O-CD1 3.08Å; K526-Y530 WeakPolarHBondContact O-CE1 3.38Å; G527-Y530 PolarHBondContact O-N 3.25Å; G527-Y530 VanDerWaalsContact O-N 3.09Å; Y530-D532 PolarHBondContact O-N 2.92Å; Y530-D532 VanDerWaalsContact O-N 3.11Å; Y530-N533 PolarHBondContact O-N 3.04Å; Y530-N533 VanDerWaalsContact O-N 3.15Å; Y530-L534 HydrophobicContact CD2-CD1 3.82Å; Y530-L534 HydrophobicContact CD2-CG 4.37Å; Y530-L534 HydrophobicContact CE2-CD1 4.02Å
531	Q	90.9	Very high	91.9	Very high	31 Å²	31	51.6 Å²	51.6	15%	0.145	26%	0.263	C	S	.	.	G	3₁₀ helix	trans	-56.7	-26.9	-178.2	63.5	-174.4	1.1	0	0	114.7	G527 N533 L534	G527-Q531 WeakPolarHBondContact O-CB 3.48Å; G527-Q531 VanDerWaalsContact O-CG 3.27Å; G527-Q531 WeakPolarHBondContact O-CG 3.35Å; G527-Q531 PolarHBondContact O-N 2.88Å; Q531-N533 PolarHBondContact O-N 2.83Å; Q531-L534 WeakPolarHBondContact O-CB 3.33Å; Q531-L534 PolarHBondContact O-N 3.11Å; Q531-L534 VanDerWaalsContact O-N 3.13Å
532	D	89.4	Confident	91.6	Very high	120 Å²	120	48.4 Å²	48.4	64%	0.642	25%	0.247	S	C	*	.	G	3₁₀ helix	trans	-72.3	-22	-176.5	-61.6	-34.8	0	0	0	112.2	Y530 L534	Y530-D532 PolarHBondContact O-N 2.92Å; Y530-D532 VanDerWaalsContact O-N 3.11Å; D532-L534 VanDerWaalsContact C-N 3.34Å
533	N	89.5	Confident	91	Very high	146 Å²	146	46.3 Å²	46.3	78%	0.781	24%	0.242	S	C	*	.	G	3₁₀ helix	trans	-87.9	-0.4	173.5	-62.8	-28.6	0	0	0	112.8	Y530 Q531	Y530-N533 PolarHBondContact O-N 3.04Å; Y530-N533 VanDerWaalsContact O-N 3.15Å; Q531-N533 PolarHBondContact O-N 2.83Å
534	L	92.3	Very high	90	Very high	16 Å²	16	50.8 Å²	50.8	8%	0.084	27%	0.274	C	S	.	.	S	Bend	trans	-103.3	146	-174.5	-56.3	-171.8	0	0	0	112.8	G233 C236 A253 Y530 Q531 D532 Q536	G233-L534 WeakPolarHBondContact O-CD2 3.41Å; C236-L534 HydrophobicContact CB-CB 4.22Å; C236-L534 HydrophobicContact CB-CD1 4.07Å; A253-L534 HydrophobicContact CB-CD1 4.06Å; Y530-L534 HydrophobicContact CD2-CD1 3.82Å; Y530-L534 HydrophobicContact CD2-CG 4.37Å; Y530-L534 HydrophobicContact CE2-CD1 4.02Å; Q531-L534 WeakPolarHBondContact O-CB 3.33Å; Q531-L534 PolarHBondContact O-N 3.11Å; Q531-L534 VanDerWaalsContact O-N 3.13Å; D532-L534 VanDerWaalsContact C-N 3.34Å; L534-Q536 PolarHBondContact O-N 2.85Å
535	A	92.6	Very high	89	Confident	43 Å²	43	56.9 Å²	56.9	36%	0.355	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68	130.8	172.8	0	0	0	0	0	111.1	K234 T235 C236	K234-A535 PolarHBondContact O-N 3.2Å; T235-A535 CarbonylContact C-O 3.55Å; T235-A535 WeakPolarHBondContact CA-O 3.29Å; T235-A535 WeakPolarHBondContact CB-O 3.48Å; T235-A535 HydrophobicContact CG2-CB 4.31Å; C236-A535 PolarHBondContact N-O 2.91Å
536	Q	92.2	Very high	88.2	Confident	78 Å²	78	57.3 Å²	57.3	36%	0.364	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	121.9	-170.5	-57.5	-176	5.7	0	0	112	L534	L534-Q536 PolarHBondContact O-N 2.85Å
537	I	90.8	Very high	87.6	Confident	22 Å²	22	58 Å²	58	11%	0.113	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	104.7	170.9	-55.3	174.1	0	0	0	107.2	P228 T235 C236 L237 R238 A609	P228-I537 HydrophobicContact CG-CG2 4.24Å; T235-I537 HydrophobicContact CG2-CD1 4.26Å; C236-I537 PolarHBondContact O-N 3.24Å; L237-I537 CarbonylContact C-O 3.58Å; L237-I537 WeakPolarHBondContact CA-O 3.33Å; L237-I537 HydrophobicContact CD1-CB 4.21Å; L237-I537 HydrophobicContact CD1-CG2 3.87Å; R238-I537 PolarHBondContact N-O 3.41Å; I537-A609 HydrophobicContact CD1-CB 3.96Å; I537-A609 HydrophobicContact CG1-CB 3.63Å
538	N	92.4	Very high	86.9	Confident	107 Å²	107	62.2 Å²	62.2	57%	0.572	33%	0.331	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.1	130.8	171.6	-62.4	-55.3	0	0	0	109.1	R238	R238-N538 WeakPolarHBondContact CB-OD1 3.37Å
539	F	92.2	Very high	86.5	Confident	50 Å²	50	59.3 Å²	59.3	22%	0.219	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	128.4	-179.2	-164.3	-84.5	0	0	0	110.6	N223 N226 A227 P228 L237 R238 L239 T240 I541	N223-F539 WeakPolarHBondContact O-CE1 3.26Å; N226-F539 HydrophobicContact CB-CZ 4.12Å; A227-F539 HydrophobicContact CB-CD1 4.21Å; A227-F539 HydrophobicContact CB-CE1 4.1Å; P228-F539 HydrophobicContact CG-CD2 4.46Å; L237-F539 HydrophobicContact CD1-CB 3.65Å; L237-F539 HydrophobicContact CD1-CG 4.46Å; R238-F539 PolarHBondContact O-N 2.64Å; L239-F539 WeakPolarHBondContact CA-O 3.5Å; L239-F539 HydrophobicContact CD1-CB 4.28Å; L239-F539 HydrophobicContact CD1-CD1 3.78Å; L239-F539 HydrophobicContact CD1-CG 4.45Å; T240-F539 PolarHBondContact N-O 3.19Å; T240-F539 PolarHBondContact OG1-O 3.33Å; F539-I541 HydrophobicContact CD1-CG2 4.01Å; F539-I541 HydrophobicContact CE1-CG2 3.96Å
540	E	91.1	Very high	85.9	Confident	131 Å²	131	59 Å²	59	61%	0.612	31%	0.313	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-112.6	124.6	-176.8	-39.7	-164.2	137.9	0	0	109.2	T240	T240-E540 VanDerWaalsContact OG1-CA 3.26Å; T240-E540 WeakPolarHBondContact OG1-CA 3.48Å; T240-E540 WeakPolarHBondContact OG1-CB 3.23Å; T240-E540 WeakPolarHBondContact OG1-CG 3.49Å
541	I	90.7	Very high	85.2	Confident	1 Å²	1	61.7 Å²	61.7	1%	0.005	33%	0.328	C	S	.	.	S	Bend	trans	-92.6	-11.3	-178.6	60.9	177.2	0	0	0	113.7	W220 N223 L224 L239 T240 V241 F539	W220-I541 HydrophobicContact CD2-CD1 3.89Å; W220-I541 HydrophobicContact CE3-CD1 4.42Å; W220-I541 HydrophobicContact CG-CD1 4.44Å; W220-I541 HydrophobicContact CH2-CD1 4.04Å; W220-I541 HydrophobicContact CZ2-CD1 3.48Å; W220-I541 VanDerWaalsContact CZ2-CD1 3.48Å; W220-I541 HydrophobicContact CZ3-CD1 4.46Å; N223-I541 HydrophobicContact CB-CB 3.99Å; N223-I541 HydrophobicContact CB-CG2 4.3Å; N223-I541 VanDerWaalsContact CB-O 3.31Å; N223-I541 WeakPolarHBondContact CB-O 3.32Å; N223-I541 PolarHBondContact ND2-O 2.94Å; L224-I541 HydrophobicContact CB-CD1 4.35Å; L224-I541 HydrophobicContact CB-CG2 4.23Å; L224-I541 HydrophobicContact CD1-CD1 4.33Å; L224-I541 HydrophobicContact CD1-CG2 4.46Å; L239-I541 HydrophobicContact CD1-CG2 3.67Å; T240-I541 WeakPolarHBondContact O-CG1 3.47Å; T240-I541 PolarHBondContact O-N 3.32Å; V241-I541 HydrophobicContact CB-CD1 4.36Å; V241-I541 HydrophobicContact CG1-CD1 4.12Å; F539-I541 HydrophobicContact CD1-CG2 4.01Å; F539-I541 HydrophobicContact CE1-CG2 3.96Å
542	W	86.1	Confident	84.7	Confident	34 Å²	34	61.2 Å²	61.2	13%	0.129	33%	0.33	C	S	.	.	S	Bend	trans	-120.6	162.3	-177.5	73.5	-75.5	0	0	0	109.5	G242 P243 Q546 T547 Y550	G242-W542 VanDerWaalsContact C-CE2 3.44Å; G242-W542 VanDerWaalsContact CA-CD1 3.42Å; G242-W542 PolarHBondContact O-NE1 3.47Å; G242-W542 VanDerWaalsContact O-NE1 3.1Å; P243-W542 HydrophobicContact CB-CH2 4.41Å; P243-W542 HydrophobicContact CB-CZ2 4.36Å; P243-W542 HydrophobicContact CG-CH2 3.98Å; P243-W542 HydrophobicContact CG-CZ2 4.14Å; P243-W542 HydrophobicContact CG-CZ3 4.2Å; W542-Q546 HydrophobicContact CE3-CB 4.26Å; W542-T547 HydrophobicContact CH2-CG2 3.78Å; W542-T547 WeakPolarHBondContact CH2-OG1 3.42Å; W542-T547 VanDerWaalsContact CZ3-CA 3.48Å; W542-T547 HydrophobicContact CZ3-CG2 4.06Å; W542-T547 WeakPolarHBondContact CZ3-OG1 3.39Å; W542-Y550 HydrophobicContact CB-CE2 4.23Å; W542-Y550 HydrophobicContact CE3-CD2 4.23Å; W542-Y550 HydrophobicContact CE3-CE2 4.21Å
543	S	80.6	Confident	84.3	Confident	52 Å²	52	56.1 Å²	56.1	36%	0.364	30%	0.302	S	S	.	.			trans	-109.5	146.7	-177.4	62.8	0	0	0	0	111.8	E545 Q546	S543-E545 PolarHBondContact O-N 3.2Å; S543-Q546 WeakPolarHBondContact O-CB 3.47Å; S543-Q546 PolarHBondContact O-N 3.1Å; S543-Q546 VanDerWaalsContact OG-CD 3.25Å; S543-Q546 WeakPolarHBondContact OG-CG 3.28Å; S543-Q546 PolarHBondContact OG-OE1 3.4Å
544	S	74.4	Confident	83.7	Confident	95 Å²	95	51.2 Å²	51.2	66%	0.664	28%	0.276	S	S	*	.	G	3₁₀ helix	trans	-55	-25.1	179.3	58.9	0	0	0	0	114	Q546 T547	S544-Q546 PolarHBondContact O-N 2.93Å; S544-T547 PolarHBondContact O-N 2.74Å; S544-T547 PolarHBondContact O-OG1 3.39Å
545	E	73.4	Confident	83	Confident	128 Å²	128	56 Å²	56	60%	0.598	30%	0.297	S	S	*	.	G	3₁₀ helix	trans	-68.4	-20.9	174.5	-60.3	-166.3	171.7	0	0	113.7	S543 R549	S543-E545 PolarHBondContact O-N 3.2Å; E545-R549 PolarHBondContact O-NH1 3.04Å; E545-R549 PolarHBondContact O-NH2 2.97Å; E545-R549 VanDerWaalsContact O-NH2 3.14Å
546	Q	77	Confident	82.1	Confident	9 Å²	9	54.5 Å²	54.5	4%	0.042	28%	0.282	C	S	.	.	G	3₁₀ helix	trans	-88	-11.2	177.7	-63.9	161	-29.2	0	0	112.8	E216 W542 S543 S544 D548 R549 Y550	E216-Q546 HydrophobicContact CG-CG 4.33Å; W542-Q546 HydrophobicContact CE3-CB 4.26Å; S543-Q546 WeakPolarHBondContact O-CB 3.47Å; S543-Q546 PolarHBondContact O-N 3.1Å; S543-Q546 VanDerWaalsContact OG-CD 3.25Å; S543-Q546 WeakPolarHBondContact OG-CG 3.28Å; S543-Q546 PolarHBondContact OG-OE1 3.4Å; S544-Q546 PolarHBondContact O-N 2.93Å; Q546-D548 VanDerWaalsContact C-N 3.34Å; Q546-D548 PolarHBondContact O-N 2.86Å; Q546-R549 PolarHBondContact O-N 2.78Å; Q546-Y550 HydrophobicContact CB-CD2 3.9Å; Q546-Y550 HydrophobicContact CB-CE2 3.54Å; Q546-Y550 HydrophobicContact CG-CE2 4.42Å; Q546-Y550 VanDerWaalsContact O-CD2 3.31Å; Q546-Y550 WeakPolarHBondContact O-CD2 3.4Å; Q546-Y550 PolarHBondContact O-N 3.48Å
547	T	79.7	Confident	81.2	Confident	32 Å²	32	55.3 Å²	55.3	20%	0.196	29%	0.286	C	S	.	.	H	α-helix	trans	-51.7	-55.2	-173.7	-38.8	0	0	0	0	110.6	P243 W542 S544 R549 Y550 L551	P243-T547 HydrophobicContact CB-CG2 4.22Å; P243-T547 HydrophobicContact CG-CG2 3.98Å; W542-T547 HydrophobicContact CH2-CG2 3.78Å; W542-T547 WeakPolarHBondContact CH2-OG1 3.42Å; W542-T547 VanDerWaalsContact CZ3-CA 3.48Å; W542-T547 HydrophobicContact CZ3-CG2 4.06Å; W542-T547 WeakPolarHBondContact CZ3-OG1 3.39Å; S544-T547 PolarHBondContact O-N 2.74Å; S544-T547 PolarHBondContact O-OG1 3.39Å; T547-R549 PolarHBondContact O-N 2.98Å; T547-Y550 PolarHBondContact O-N 2.79Å; T547-L551 HydrophobicContact CG2-CD1 3.98Å; T547-L551 WeakPolarHBondContact O-CG 3.42Å; T547-L551 PolarHBondContact O-N 2.84Å
548	D	76.2	Confident	80.4	Confident	96 Å²	96	58 Å²	58	51%	0.513	31%	0.307	S	S	.	.	H	α-helix	trans	-66.5	-30.5	-173.9	-54.4	-24	0	0	0	110.9	Q546 A552 P577	Q546-D548 VanDerWaalsContact C-N 3.34Å; Q546-D548 PolarHBondContact O-N 2.86Å; D548-A552 WeakPolarHBondContact O-CB 3.33Å; D548-A552 PolarHBondContact O-N 2.54Å; D548-P577 HydrophobicContact CB-CB 4.13Å; D548-P577 HydrophobicContact CB-CG 3.61Å
549	R	80	Confident	79.2	Confident	18 Å²	18	55.4 Å²	55.4	7%	0.068	30%	0.295	C	S	.	.	H	α-helix	trans	-71.1	-44.3	175.8	-73.8	-170.6	-70	-64.4	2.7	111.4	E216 E545 Q546 T547 A552 L553 F576 P577	E216-R549 VanDerWaalsContact CD-NH2 3.31Å; E216-R549 IonicContact OE1-CZ 2.76Å; E216-R549 VanDerWaalsContact OE1-CZ 3.25Å; E216-R549 IonicContact OE1-NE 2.91Å; E216-R549 PolarHBondContact OE1-NE 3.32Å; E216-R549 IonicContact OE1-NH2 2.84Å; E216-R549 PolarHBondContact OE1-NH2 3.33Å; E216-R549 IonicContact OE2-CZ 2.86Å; E216-R549 IonicContact OE2-NE 2.83Å; E216-R549 PolarHBondContact OE2-NE 3.49Å; E216-R549 IonicContact OE2-NH2 3.26Å; E216-R549 PolarHBondContact OE2-NH2 3.31Å; E545-R549 PolarHBondContact O-NH1 3.04Å; E545-R549 PolarHBondContact O-NH2 2.97Å; E545-R549 VanDerWaalsContact O-NH2 3.14Å; Q546-R549 PolarHBondContact O-N 2.78Å; T547-R549 PolarHBondContact O-N 2.98Å; R549-A552 PolarHBondContact O-N 3.28Å; R549-L553 WeakPolarHBondContact O-CB 3.15Å; R549-L553 VanDerWaalsContact O-CG 3.26Å; R549-L553 WeakPolarHBondContact O-CG 3.48Å; R549-L553 PolarHBondContact O-N 2.98Å; R549-F576 HydrophobicContact CB-CZ 4.25Å; R549-F576 HydrophobicContact CG-CE1 3.93Å; R549-F576 HydrophobicContact CG-CZ 4.12Å; R549-P577 HydrophobicContact CG-CB 3.9Å; R549-P577 HydrophobicContact CG-CG 4.13Å
550	Y	79.2	Confident	77.3	Confident	18 Å²	18	59.8 Å²	59.8	7%	0.071	32%	0.321	C	S	.	.	H	α-helix	trans	-64.2	-41.6	175	-68.9	-55.8	0	0	0	112.1	I170 P243 W542 Q546 T547 L553 N554	I170-Y550 HydrophobicContact CD1-CE1 4.04Å; I170-Y550 HydrophobicContact CG1-CD1 4.39Å; I170-Y550 HydrophobicContact CG1-CE1 4.07Å; I170-Y550 HydrophobicContact CG2-CE1 3.82Å; P243-Y550 HydrophobicContact CG-CD2 4.48Å; W542-Y550 HydrophobicContact CB-CE2 4.23Å; W542-Y550 HydrophobicContact CE3-CD2 4.23Å; W542-Y550 HydrophobicContact CE3-CE2 4.21Å; Q546-Y550 HydrophobicContact CB-CD2 3.9Å; Q546-Y550 HydrophobicContact CB-CE2 3.54Å; Q546-Y550 HydrophobicContact CG-CE2 4.42Å; Q546-Y550 VanDerWaalsContact O-CD2 3.31Å; Q546-Y550 WeakPolarHBondContact O-CD2 3.4Å; Q546-Y550 PolarHBondContact O-N 3.48Å; T547-Y550 PolarHBondContact O-N 2.79Å; Y550-L553 PolarHBondContact O-N 2.74Å; Y550-N554 WeakPolarHBondContact O-CB 3.44Å; Y550-N554 PolarHBondContact O-N 2.88Å
551	L	79.6	Confident	75.4	Confident	68 Å²	68	56.2 Å²	56.2	36%	0.356	31%	0.305	S	S	.	.	H	α-helix	trans	-63.7	-44.4	174.7	-67.9	173.8	0	0	0	111.8	L246 T547 N554 F555	L246-L551 HydrophobicContact CD1-CD2 4.15Å; L246-L551 HydrophobicContact CD2-CD2 4.43Å; L246-L551 HydrophobicContact CG-CD2 4.2Å; T547-L551 HydrophobicContact CG2-CD1 3.98Å; T547-L551 WeakPolarHBondContact O-CG 3.42Å; T547-L551 PolarHBondContact O-N 2.84Å; L551-N554 PolarHBondContact O-N 3.19Å; L551-F555 WeakPolarHBondContact O-CB 3.4Å; L551-F555 PolarHBondContact O-N 3.1Å
552	A	78.9	Confident	73.4	Confident	22 Å²	22	62.4 Å²	62.4	18%	0.182	34%	0.339	C	S	.	.	H	α-helix	trans	-64.3	-42.4	176.3	0	0	0	0	0	112.5	D548 R549 F555 I556 F576 P577	D548-A552 WeakPolarHBondContact O-CB 3.33Å; D548-A552 PolarHBondContact O-N 2.54Å; R549-A552 PolarHBondContact O-N 3.28Å; A552-F555 PolarHBondContact O-N 3.13Å; A552-I556 WeakPolarHBondContact O-CB 3.47Å; A552-I556 WeakPolarHBondContact O-CD1 3.25Å; A552-I556 WeakPolarHBondContact O-CG1 3.4Å; A552-I556 PolarHBondContact O-N 3.33Å; A552-F576 HydrophobicContact CB-CD2 4.03Å; A552-F576 HydrophobicContact CB-CE2 4.04Å; A552-P577 HydrophobicContact CB-CG 4.45Å
553	L	80.7	Confident	71.6	Confident	12 Å²	12	66 Å²	66	6%	0.063	37%	0.369	C	S	.	.	H	α-helix	trans	-61.2	-42.9	174.4	-75.9	170.6	0	0	0	111.7	R173 Y177 R549 Y550 I556 H557 F576	R173-L553 HydrophobicContact CB-CB 4.35Å; Y177-L553 HydrophobicContact CD1-CD2 4.19Å; Y177-L553 HydrophobicContact CD2-CD2 4.46Å; Y177-L553 HydrophobicContact CG-CD2 3.89Å; R549-L553 WeakPolarHBondContact O-CB 3.15Å; R549-L553 VanDerWaalsContact O-CG 3.26Å; R549-L553 WeakPolarHBondContact O-CG 3.48Å; R549-L553 PolarHBondContact O-N 2.98Å; Y550-L553 PolarHBondContact O-N 2.74Å; L553-I556 PolarHBondContact O-N 3.44Å; L553-H557 WeakPolarHBondContact O-CB 3.35Å; L553-H557 PolarHBondContact O-N 3.44Å; L553-F576 HydrophobicContact CD2-CE2 3.94Å; L553-F576 HydrophobicContact CD2-CZ 4.16Å; L553-F576 HydrophobicContact CG-CE2 3.94Å; L553-F576 HydrophobicContact CG-CZ 4.07Å
554	N	77.2	Confident	70.1	Confident	43 Å²	43	69.9 Å²	69.9	23%	0.23	39%	0.386	C	S	.	.	H	α-helix	trans	-68.6	-37.1	177.2	-166.3	44.8	0	0	0	112.2	R173 L246 Y550 L551 H557 S558	R173-N554 PolarHBondContact NE-OD1 2.81Å; R173-N554 PolarHBondContact NH2-OD1 3.25Å; L246-N554 HydrophobicContact CD1-CB 4.33Å; L246-N554 HydrophobicContact CD2-CB 4.42Å; L246-N554 VanDerWaalsContact CD2-ND2 3.29Å; L246-N554 WeakPolarHBondContact CD2-ND2 3.47Å; Y550-N554 WeakPolarHBondContact O-CB 3.44Å; Y550-N554 PolarHBondContact O-N 2.88Å; L551-N554 PolarHBondContact O-N 3.19Å; N554-H557 PolarHBondContact O-N 3.31Å; N554-S558 WeakPolarHBondContact O-CB 3.39Å; N554-S558 PolarHBondContact O-N 3.06Å; N554-S558 PolarHBondContact O-OG 3.01Å
555	F	77.6	Confident	69.1	Low	117 Å²	117	69.2 Å²	69.2	51%	0.513	37%	0.374	S	S	.	.	H	α-helix	trans	-59.5	-50.5	171.6	-178.7	-100.7	0	0	0	111.1	L551 A552 H557 S558 V559	L551-F555 WeakPolarHBondContact O-CB 3.4Å; L551-F555 PolarHBondContact O-N 3.1Å; A552-F555 PolarHBondContact O-N 3.13Å; F555-H557 VanDerWaalsContact C-N 3.26Å; F555-H557 PolarHBondContact O-N 2.66Å; F555-S558 PolarHBondContact O-N 2.76Å; F555-S558 PolarHBondContact O-OG 3.4Å; F555-V559 HydrophobicContact CD1-CG2 4.29Å; F555-V559 HydrophobicContact CD2-CG2 4.47Å; F555-V559 HydrophobicContact CE1-CG2 3.89Å; F555-V559 HydrophobicContact CE2-CG2 4.09Å; F555-V559 HydrophobicContact CZ-CG2 3.79Å; F555-V559 WeakPolarHBondContact O-CG2 3.5Å; F555-V559 PolarHBondContact O-N 3.05Å
556	I	74.3	Confident	68.3	Low	11 Å²	11	67.5 Å²	67.5	6%	0.056	37%	0.369	C	S	.	.	H	α-helix	trans	-59.5	-34.1	178.6	-69.7	161.8	0	0	0	112.8	Y177 A552 L553 F569 V572 F576	Y177-I556 HydrophobicContact CD2-CD1 3.71Å; Y177-I556 HydrophobicContact CD2-CG2 4.31Å; Y177-I556 HydrophobicContact CE2-CD1 3.77Å; A552-I556 WeakPolarHBondContact O-CB 3.47Å; A552-I556 WeakPolarHBondContact O-CD1 3.25Å; A552-I556 WeakPolarHBondContact O-CG1 3.4Å; A552-I556 PolarHBondContact O-N 3.33Å; L553-I556 PolarHBondContact O-N 3.44Å; I556-F569 HydrophobicContact CG2-CE2 4.37Å; I556-V572 HydrophobicContact CD1-CG1 3.8Å; I556-V572 HydrophobicContact CG1-CG1 3.47Å; I556-V572 VanDerWaalsContact CG1-CG1 3.47Å; I556-F576 HydrophobicContact CD1-CD2 3.97Å; I556-F576 HydrophobicContact CD1-CE2 4.26Å
557	H	73.6	Confident	67.4	Low	95 Å²	95	71.5 Å²	71.5	44%	0.44	39%	0.393	S	S	.	.	H	α-helix	trans	-71.8	-40.8	173.9	-176.8	67.7	0	0	0	111.9	R173 E176 L553 N554 F555 V559	R173-H557 HydrophobicContact CG-CB 4.17Å; E176-H557 IonicContact OE2-CE1 2.69Å; E176-H557 IonicContact OE2-CG 3.62Å; E176-H557 IonicContact OE2-ND1 2.74Å; E176-H557 PolarHBondContact OE2-ND1 3.14Å; L553-H557 WeakPolarHBondContact O-CB 3.35Å; L553-H557 PolarHBondContact O-N 3.44Å; N554-H557 PolarHBondContact O-N 3.31Å; F555-H557 VanDerWaalsContact C-N 3.26Å; F555-H557 PolarHBondContact O-N 2.66Å; H557-V559 PolarHBondContact O-N 3.33Å
558	S	73.3	Confident	66.5	Low	79 Å²	79	73 Å²	73	55%	0.552	40%	0.4	S	S	*	.	H	α-helix	trans	-68.9	-29.7	179.3	73.3	0	0	0	0	114	N554 F555 N560	N554-S558 WeakPolarHBondContact O-CB 3.39Å; N554-S558 PolarHBondContact O-N 3.06Å; N554-S558 PolarHBondContact O-OG 3.01Å; F555-S558 PolarHBondContact O-N 2.76Å; F555-S558 PolarHBondContact O-OG 3.4Å; S558-N560 PolarHBondContact O-N 3.25Å; S558-N560 VanDerWaalsContact O-N 3.09Å
559	V	66.6	Low	66.1	Low	53 Å²	53	69.1 Å²	69.1	32%	0.321	38%	0.379	S	S	.	.	S	Bend	trans	-80.7	93.1	175.3	-172.2	0	0	0	0	108.9	F555 H557 L561	F555-V559 HydrophobicContact CD1-CG2 4.29Å; F555-V559 HydrophobicContact CD2-CG2 4.47Å; F555-V559 HydrophobicContact CE1-CG2 3.89Å; F555-V559 HydrophobicContact CE2-CG2 4.09Å; F555-V559 HydrophobicContact CZ-CG2 3.79Å; F555-V559 WeakPolarHBondContact O-CG2 3.5Å; F555-V559 PolarHBondContact O-N 3.05Å; H557-V559 PolarHBondContact O-N 3.33Å; V559-L561 HydrophobicContact CG1-CD2 3.69Å; V559-L561 HydrophobicContact CG1-CG 3.79Å; V559-L561 PolarHBondContact O-N 3.48Å
560	N	53	Low	65.3	Low	142 Å²	142	73.2 Å²	73.2	76%	0.759	40%	0.399	S	S	*	.			trans	-70.5	72.1	176	-166.7	16.5	0	0	0	111.3	S558 N562	S558-N560 PolarHBondContact O-N 3.25Å; S558-N560 VanDerWaalsContact O-N 3.09Å; N560-N562 PolarHBondContact O-N 3.05Å
561	L	51.6	Low	64.6	Low	55 Å²	55	78 Å²	78	29%	0.288	42%	0.423	S	S	.	.			trans	-68.9	109	173.3	-65.1	178.8	0	0	0	109.1	V559 D565 N568	V559-L561 HydrophobicContact CG1-CD2 3.69Å; V559-L561 HydrophobicContact CG1-CG 3.79Å; V559-L561 PolarHBondContact O-N 3.48Å; L561-D565 HydrophobicContact CD2-CB 4.43Å; L561-N568 HydrophobicContact CD1-CB 4.22Å; L561-N568 HydrophobicContact CD2-CB 4.39Å
562	N	47.4	Very low	63.9	Low	132 Å²	132	77 Å²	77	71%	0.706	42%	0.42	S	S	*	.			trans	-55.4	154	159.9	-68.7	-39.3	0	0	0	109.4	N560 D564	N560-N562 PolarHBondContact O-N 3.05Å; N562-D564 PolarHBondContact O-N 3.28Å
563	S	49.3	Very low	63.6	Low	109 Å²	109	78.2 Å²	78.2	76%	0.762	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.7	-5.2	-160.1	48.5	0	0	0	0	118.9
564	D	48.8	Very low	62.9	Low	134 Å²	134	84 Å²	84	72%	0.717	45%	0.448	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108	-11.2	-158.6	-60.3	2.4	0	0	0	113.2	N562 I566	N562-D564 PolarHBondContact O-N 3.28Å; D564-I566 PolarHBondContact O-N 3.34Å
565	D	53.8	Low	62.2	Low	80 Å²	80	88.1 Å²	88.1	43%	0.428	47%	0.47	S	S	.	.			trans	-95	60.7	-179.3	-84.2	-8.7	0	0	0	113.2	L561 T567 N568 F569	L561-D565 HydrophobicContact CD2-CB 4.43Å; D565-T567 PolarHBondContact O-N 3.28Å; D565-N568 HydrophobicContact CB-CB 4.14Å; D565-N568 VanDerWaalsContact CG-ND2 3.33Å; D565-N568 PolarHBondContact O-N 3.48Å; D565-N568 PolarHBondContact OD2-ND2 3.48Å; D565-F569 PolarHBondContact O-N 3.32Å
566	I	56.5	Low	61.9	Low	93 Å²	93	83 Å²	83	48%	0.477	45%	0.448	S	S	.	.	H	α-helix	trans	-56.1	-37.8	176	-65.4	172	0	0	0	111.5	V184 D564 N568 F569 E570	V184-I566 HydrophobicContact CG1-CG2 4.17Å; V184-I566 HydrophobicContact CG2-CG2 4.06Å; D564-I566 PolarHBondContact O-N 3.34Å; I566-N568 PolarHBondContact O-N 2.84Å; I566-F569 PolarHBondContact O-N 2.98Å; I566-E570 PolarHBondContact O-N 2.65Å; I566-E570 VanDerWaalsContact O-N 3.07Å
567	T	57.4	Low	61.6	Low	92 Å²	92	84 Å²	84	56%	0.564	46%	0.455	S	S	*	.	H	α-helix	trans	-62.5	-37.1	-179.9	48.5	0	0	0	0	113.4	D565 M571	D565-T567 PolarHBondContact O-N 3.28Å; T567-M571 PolarHBondContact O-N 3.3Å; T567-M571 VanDerWaalsContact O-N 3.16Å
568	N	61.4	Low	61.2	Low	64 Å²	64	87 Å²	87	34%	0.342	47%	0.467	S	S	.	.	H	α-helix	trans	-70.1	-37.3	177.7	-72.2	-27.7	0	0	0	110.9	L561 D565 I566 V572	L561-N568 HydrophobicContact CD1-CB 4.22Å; L561-N568 HydrophobicContact CD2-CB 4.39Å; D565-N568 HydrophobicContact CB-CB 4.14Å; D565-N568 VanDerWaalsContact CG-ND2 3.33Å; D565-N568 PolarHBondContact O-N 3.48Å; D565-N568 PolarHBondContact OD2-ND2 3.48Å; I566-N568 PolarHBondContact O-N 2.84Å; N568-V572 VanDerWaalsContact O-CG2 3.3Å; N568-V572 WeakPolarHBondContact O-CG2 3.47Å; N568-V572 PolarHBondContact O-N 2.92Å; N568-V572 VanDerWaalsContact O-N 3.08Å
569	F	66.8	Low	60.6	Low	14 Å²	14	85.3 Å²	85.3	6%	0.061	45%	0.45	C	S	.	.	H	α-helix	trans	-67.4	-40.9	175.5	-174.4	-92.2	0	0	0	112.3	Y177 K180 L181 V184 I556 D565 I566 V572 H573	Y177-F569 HydrophobicContact CD2-CE2 4.13Å; Y177-F569 AromaticContact CD2-CZ 3.97Å; Y177-F569 HydrophobicContact CD2-CZ 3.97Å; Y177-F569 HydrophobicContact CE2-CE2 4.45Å; Y177-F569 HydrophobicContact CE2-CZ 4.05Å; K180-F569 HydrophobicContact CB-CD2 3.88Å; K180-F569 HydrophobicContact CB-CE1 4.18Å; K180-F569 HydrophobicContact CB-CE2 3.42Å; K180-F569 VanDerWaalsContact CB-CE2 3.42Å; K180-F569 HydrophobicContact CB-CG 4.42Å; K180-F569 HydrophobicContact CB-CZ 3.59Å; K180-F569 HydrophobicContact CD-CD2 4Å; K180-F569 HydrophobicContact CD-CE2 3.87Å; K180-F569 HydrophobicContact CG-CE2 4.25Å; L181-F569 HydrophobicContact CB-CE1 3.99Å; L181-F569 HydrophobicContact CB-CZ 4.08Å; L181-F569 HydrophobicContact CD1-CE1 4.01Å; V184-F569 HydrophobicContact CG2-CD1 4.49Å; I556-F569 HydrophobicContact CG2-CE2 4.37Å; D565-F569 PolarHBondContact O-N 3.32Å; I566-F569 PolarHBondContact O-N 2.98Å; F569-V572 PolarHBondContact O-N 2.85Å; F569-H573 HydrophobicContact CE1-CB 4.24Å; F569-H573 WeakPolarHBondContact O-CB 3.34Å; F569-H573 PolarHBondContact O-N 3.08Å
570	E	64.7	Low	60	Low	104 Å²	104	88.5 Å²	88.5	49%	0.486	47%	0.465	S	S	.	.	H	α-helix	trans	-60.8	-45.9	175.7	-72.7	-173.2	150.2	0	0	111.9	I566 V572 H573 E574	I566-E570 PolarHBondContact O-N 2.65Å; I566-E570 VanDerWaalsContact O-N 3.07Å; E570-V572 VanDerWaalsContact C-N 3.34Å; E570-V572 PolarHBondContact O-N 3.24Å; E570-H573 PolarHBondContact O-N 3.23Å; E570-E574 WeakPolarHBondContact O-CG 3.31Å; E570-E574 PolarHBondContact O-N 3.2Å
571	M	64	Low	59.6	Low	119 Å²	119	88.1 Å²	88.1	59%	0.586	47%	0.468	S	S	*	.	H	α-helix	trans	-59.1	-40.5	174	-88	-179.7	49.8	0	0	113.2	T567 N575	T567-M571 PolarHBondContact O-N 3.3Å; T567-M571 VanDerWaalsContact O-N 3.16Å; M571-N575 PolarHBondContact O-N 3.18Å; M571-N575 PolarHBondContact O-ND2 3.25Å
572	V	64.7	Low	59	Low	47 Å²	47	91.8 Å²	91.8	29%	0.285	49%	0.493	S	S	.	.	H	α-helix	trans	-73.9	-33.5	178.9	176.4	0	0	0	0	111.3	I556 N568 F569 E570 N575 F576	I556-V572 HydrophobicContact CD1-CG1 3.8Å; I556-V572 HydrophobicContact CG1-CG1 3.47Å; I556-V572 VanDerWaalsContact CG1-CG1 3.47Å; N568-V572 VanDerWaalsContact O-CG2 3.3Å; N568-V572 WeakPolarHBondContact O-CG2 3.47Å; N568-V572 PolarHBondContact O-N 2.92Å; N568-V572 VanDerWaalsContact O-N 3.08Å; F569-V572 PolarHBondContact O-N 2.85Å; E570-V572 VanDerWaalsContact C-N 3.34Å; E570-V572 PolarHBondContact O-N 3.24Å; V572-N575 CarbonylContact O-C 3.59Å; V572-N575 PolarHBondContact O-N 3.2Å; V572-F576 PolarHBondContact O-N 2.95Å; V572-F576 VanDerWaalsContact O-N 3.08Å
573	H	71.9	Confident	58.6	Low	48 Å²	48	90.6 Å²	90.6	22%	0.222	49%	0.49	C	S	.	.	H	α-helix	trans	-67.1	-40.3	172.6	178.3	68.2	0	0	0	112.4	Y177 L181 F569 E570 N575 F576	Y177-H573 AromaticContact CZ-ND1 3.72Å; Y177-H573 PolarHBondContact OH-CE1 3.09Å; Y177-H573 PolarHBondContact OH-ND1 3.36Å; L181-H573 VanDerWaalsContact CD1-CE1 3.49Å; L181-H573 WeakPolarHBondContact CD1-CE1 3.4Å; F569-H573 HydrophobicContact CE1-CB 4.24Å; F569-H573 WeakPolarHBondContact O-CB 3.34Å; F569-H573 PolarHBondContact O-N 3.08Å; E570-H573 PolarHBondContact O-N 3.23Å; H573-N575 PolarHBondContact O-N 3.17Å; H573-F576 VanDerWaalsContact O-CB 3.23Å; H573-F576 WeakPolarHBondContact O-CB 3.39Å; H573-F576 PolarHBondContact O-N 3.22Å
574	E	66.4	Low	57.7	Low	132 Å²	132	92.5 Å²	92.5	62%	0.617	49%	0.492	S	S	*	.	H	α-helix	trans	-61.8	-30	175.6	-77.1	-157.7	145.1	0	0	113.2	E570 K578	E570-E574 WeakPolarHBondContact O-CG 3.31Å; E570-E574 PolarHBondContact O-N 3.2Å; E574-K578 WeakPolarHBondContact O-CE 3.36Å; E574-K578 PolarHBondContact O-NZ 3.23Å
575	N	64.1	Low	57	Low	130 Å²	130	91.5 Å²	91.5	70%	0.695	49%	0.486	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.3	-2.4	175.3	-70.5	-60.8	0	0	0	113.7	M571 V572 H573	M571-N575 PolarHBondContact O-N 3.18Å; M571-N575 PolarHBondContact O-ND2 3.25Å; V572-N575 CarbonylContact O-C 3.59Å; V572-N575 PolarHBondContact O-N 3.2Å; H573-N575 PolarHBondContact O-N 3.17Å
576	F	70.5	Confident	56.2	Low	11 Å²	11	95.4 Å²	95.4	5%	0.048	51%	0.507	C	S	.	.	S	Bend	trans	-62.2	131.8	175.5	-165.6	-94.8	0	0	0	109.4	Y177 L209 R549 A552 L553 I556 V572 H573 K578	Y177-F576 HydrophobicContact CE1-CE2 4.38Å; Y177-F576 HydrophobicContact CE1-CZ 4.36Å; Y177-F576 AromaticContact CE2-CD2 3.86Å; Y177-F576 HydrophobicContact CE2-CD2 3.86Å; Y177-F576 HydrophobicContact CE2-CE2 4.13Å; Y177-F576 HydrophobicContact CE2-CG 4.37Å; Y177-F576 AromaticContact CZ-CD2 3.77Å; Y177-F576 AromaticContact CZ-CE2 3.97Å; Y177-F576 AromaticContact CZ-CG 3.93Å; Y177-F576 WeakPolarHBondContact OH-CD1 3.12Å; Y177-F576 WeakPolarHBondContact OH-CG 3.33Å; L209-F576 HydrophobicContact CD1-CD1 4.4Å; L209-F576 HydrophobicContact CD1-CE1 4.24Å; R549-F576 HydrophobicContact CB-CZ 4.25Å; R549-F576 HydrophobicContact CG-CE1 3.93Å; R549-F576 HydrophobicContact CG-CZ 4.12Å; A552-F576 HydrophobicContact CB-CD2 4.03Å; A552-F576 HydrophobicContact CB-CE2 4.04Å; L553-F576 HydrophobicContact CD2-CE2 3.94Å; L553-F576 HydrophobicContact CD2-CZ 4.16Å; L553-F576 HydrophobicContact CG-CE2 3.94Å; L553-F576 HydrophobicContact CG-CZ 4.07Å; I556-F576 HydrophobicContact CD1-CD2 3.97Å; I556-F576 HydrophobicContact CD1-CE2 4.26Å; V572-F576 PolarHBondContact O-N 2.95Å; V572-F576 VanDerWaalsContact O-N 3.08Å; H573-F576 VanDerWaalsContact O-CB 3.23Å; H573-F576 WeakPolarHBondContact O-CB 3.39Å; H573-F576 PolarHBondContact O-N 3.22Å; F576-K578 PolarHBondContact O-N 3.05Å
577	P	68.4	Low	55.4	Low	31 Å²	31	98.2 Å²	98.2	20%	0.201	52%	0.523	C	S	.	.			trans	-56.7	109.6	-169.2	-28.1	35	0	0	0	113	D548 R549 A552	D548-P577 HydrophobicContact CB-CB 4.13Å; D548-P577 HydrophobicContact CB-CG 3.61Å; R549-P577 HydrophobicContact CG-CB 3.9Å; R549-P577 HydrophobicContact CG-CG 4.13Å; A552-P577 HydrophobicContact CB-CG 4.45Å
578	K	65.5	Low	54.7	Low	158 Å²	158	98 Å²	98	69%	0.687	52%	0.518	S	S	*	.			trans	-74.6	131.9	-177.2	-65.4	173	-174.2	160.5	0	109.2	E574 F576 N580	E574-K578 WeakPolarHBondContact O-CE 3.36Å; E574-K578 PolarHBondContact O-NZ 3.23Å; F576-K578 PolarHBondContact O-N 3.05Å; K578-N580 PolarHBondContact O-N 3.14Å
579	F	60.1	Low	53.9	Low	43 Å²	43	102.3 Å²	102.3	19%	0.189	54%	0.538	C	S	.	.			trans	-57.5	131.8	178	-52.5	-81.7	0	0	0	111.2	L209 K212 V213 E216 T581	L209-F579 HydrophobicContact CB-CE2 4.46Å; L209-F579 HydrophobicContact CD1-CE2 3.5Å; L209-F579 HydrophobicContact CD1-CZ 3.79Å; K212-F579 HydrophobicContact CB-CD1 4.35Å; K212-F579 HydrophobicContact CB-CE1 3.64Å; K212-F579 HydrophobicContact CB-CE2 3.94Å; K212-F579 HydrophobicContact CB-CZ 3.41Å; K212-F579 VanDerWaalsContact CB-CZ 3.41Å; K212-F579 HydrophobicContact CD-CB 4.27Å; K212-F579 HydrophobicContact CD-CD1 3.74Å; K212-F579 HydrophobicContact CD-CD2 3.46Å; K212-F579 VanDerWaalsContact CD-CD2 3.46Å; K212-F579 HydrophobicContact CD-CE1 3.86Å; K212-F579 HydrophobicContact CD-CE2 3.6Å; K212-F579 HydrophobicContact CD-CG 3.53Å; K212-F579 HydrophobicContact CD-CZ 3.79Å; K212-F579 HydrophobicContact CG-CE1 4.38Å; K212-F579 HydrophobicContact CG-CE2 4.41Å; K212-F579 HydrophobicContact CG-CZ 4.26Å; V213-F579 HydrophobicContact CG2-CZ 4.39Å; E216-F579 WeakPolarHBondContact OE1-CE1 3.39Å; F579-T581 PolarHBondContact O-N 2.72Å; F579-T581 VanDerWaalsContact O-N 3.1Å
580	N	54.4	Low	53.5	Low	121 Å²	121	105.8 Å²	105.8	65%	0.647	55%	0.551	S	S	*	*			trans	-56.1	115.8	176.3	-76.5	-34.3	0	0	0	110.6	K578 V582	K578-N580 PolarHBondContact O-N 3.14Å; N580-V582 PolarHBondContact O-N 3.19Å; N580-V582 VanDerWaalsContact O-N 3.11Å
581	T	43.3	Very low	53.6	Low	134 Å²	134	104.1 Å²	104.1	82%	0.822	55%	0.545	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.1	15.9	-175.3	47.3	0	0	0	0	114.1	F579	F579-T581 PolarHBondContact O-N 2.72Å; F579-T581 VanDerWaalsContact O-N 3.1Å
582	V	40.2	Very low	53.9	Low	132 Å²	132	99.1 Å²	99.1	80%	0.8	52%	0.521	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.2	-15.1	-171.5	-174.2	0	0	0	0	112.8	N580 N584	N580-V582 PolarHBondContact O-N 3.19Å; N580-V582 VanDerWaalsContact O-N 3.11Å; V582-N584 PolarHBondContact O-N 3.24Å
583	T	38.4	Very low	54.3	Low	106 Å²	106	99.5 Å²	99.5	65%	0.65	52%	0.52	S	S	*	.			trans	-85.6	85.8	169.2	53.4	0	0	0	0	111.2	N585	T583-N585 PolarHBondContact O-N 3.39Å
584	N	31.3	Very low	54.6	Low	149 Å²	149	101.3 Å²	101.3	80%	0.797	54%	0.538	S	S	*	.			trans	-71.4	77	172.1	-151.3	9.8	0	0	0	110.1	V582	V582-N584 PolarHBondContact O-N 3.24Å
585	N	34	Very low	55.3	Low	113 Å²	113	97.6 Å²	97.6	60%	0.604	52%	0.522	S	S	*	.			trans	-148.5	92	174.3	-97.1	-24.4	0	0	0	110.6	T583 N587 I588	T583-N585 PolarHBondContact O-N 3.39Å; N585-N587 PolarHBondContact O-N 2.98Å; N585-I588 HydrophobicContact CB-CD1 4.38Å; N585-I588 HydrophobicContact CB-CG1 3.99Å
586	N	36.8	Very low	56.3	Low	162 Å²	162	92.9 Å²	92.9	87%	0.866	50%	0.495	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.8	34.8	170.5	-69.7	-20.7	0	0	0	112.8
587	N	38.5	Very low	57.1	Low	153 Å²	153	98.2 Å²	98.2	82%	0.818	52%	0.524	S	S	*	.	T	Hydrogen-bonded Turn	trans	-156.2	21.6	-174.5	-104.6	-7.4	0	0	0	112.8	N585 M589	N585-N587 PolarHBondContact O-N 2.98Å; N587-M589 VanDerWaalsContact C-N 3.25Å; N587-M589 PolarHBondContact O-N 2.76Å
588	I	44.6	Very low	57.9	Low	87 Å²	87	97.3 Å²	97.3	45%	0.446	52%	0.518	S	S	.	.			trans	-72.6	93.1	160.7	-56.8	178.3	0	0	0	106.2	N585 Y590	N585-I588 HydrophobicContact CB-CD1 4.38Å; N585-I588 HydrophobicContact CB-CG1 3.99Å; I588-Y590 WeakPolarHBondContact O-CD2 3.4Å; I588-Y590 PolarHBondContact O-N 3.11Å; I588-Y590 VanDerWaalsContact O-N 3.16Å
589	M	44.1	Very low	58.7	Low	155 Å²	155	90.8 Å²	90.8	76%	0.764	49%	0.492	S	S	*	.			trans	-59.7	115.6	158.1	-170.6	172.4	84.4	0	0	105.6	N587 D591	N587-M589 VanDerWaalsContact C-N 3.25Å; N587-M589 PolarHBondContact O-N 2.76Å; M589-D591 HydrophobicContact CE-CB 4.42Å; M589-D591 PolarHBondContact O-N 3.43Å
590	Y	57.2	Low	59.6	Low	87 Å²	87	95.7 Å²	95.7	34%	0.341	52%	0.516	S	S	.	.			trans	-70.7	73.7	-178	-67.8	-94.1	0	0	0	109.3	F211 Y215 I588 L592	F211-Y590 HydrophobicContact CD1-CD2 4.04Å; F211-Y590 AromaticContact CD1-CE2 3.78Å; F211-Y590 HydrophobicContact CD1-CE2 3.78Å; F211-Y590 HydrophobicContact CE1-CD1 4.24Å; F211-Y590 AromaticContact CE1-CD2 3.26Å; F211-Y590 HydrophobicContact CE1-CD2 3.26Å; F211-Y590 HydrophobicContact CE1-CE1 4.44Å; F211-Y590 AromaticContact CE1-CE2 3.5Å; F211-Y590 HydrophobicContact CE1-CE2 3.5Å; F211-Y590 AromaticContact CE1-CG 3.65Å; F211-Y590 HydrophobicContact CE1-CG 3.65Å; F211-Y590 AromaticContact CZ-CD2 3.94Å; F211-Y590 HydrophobicContact CZ-CD2 3.94Å; F211-Y590 HydrophobicContact CZ-CE2 4.41Å; F211-Y590 HydrophobicContact CZ-CG 4.45Å; Y215-Y590 AromaticContact CD1-CD1 3.67Å; Y215-Y590 HydrophobicContact CD1-CD1 3.67Å; Y215-Y590 HydrophobicContact CD1-CE1 4.06Å; Y215-Y590 AromaticContact CD2-CD1 3.72Å; Y215-Y590 HydrophobicContact CD2-CD1 3.72Å; Y215-Y590 HydrophobicContact CD2-CG 4.14Å; Y215-Y590 AromaticContact CE1-CD1 3.84Å; Y215-Y590 HydrophobicContact CE1-CD1 3.84Å; Y215-Y590 HydrophobicContact CE1-CE1 4.41Å; Y215-Y590 AromaticContact CE2-CD1 3.88Å; Y215-Y590 HydrophobicContact CE2-CD1 3.88Å; Y215-Y590 HydrophobicContact CE2-CG 4.31Å; Y215-Y590 AromaticContact CG-CD1 3.59Å; Y215-Y590 HydrophobicContact CG-CD1 3.59Å; Y215-Y590 HydrophobicContact CG-CE1 4.22Å; Y215-Y590 HydrophobicContact CG-CG 4.36Å; Y215-Y590 AromaticContact CZ-CD1 3.92Å; I588-Y590 WeakPolarHBondContact O-CD2 3.4Å; I588-Y590 PolarHBondContact O-N 3.11Å; I588-Y590 VanDerWaalsContact O-N 3.16Å; Y590-L592 VanDerWaalsContact C-N 3.35Å; Y590-L592 PolarHBondContact O-N 2.99Å
591	D	67	Low	60.7	Low	69 Å²	69	93.4 Å²	93.4	37%	0.369	50%	0.504	S	S	.	.			trans	-78.2	84.3	-174.5	-175	4.7	0	0	0	110.4	M589 M593 S594	M589-D591 HydrophobicContact CE-CB 4.42Å; M589-D591 PolarHBondContact O-N 3.43Å; D591-M593 PolarHBondContact O-N 3.14Å; D591-M593 VanDerWaalsContact O-N 3.14Å; D591-M593 WeakPolarHBondContact OD1-CB 3.4Å; D591-M593 PolarHBondContact OD1-N 3.42Å; D591-M593 VanDerWaalsContact OD1-N 3.11Å; D591-S594 WeakPolarHBondContact O-CB 3.4Å; D591-S594 PolarHBondContact O-N 3.47Å; D591-S594 PolarHBondContact O-OG 2.86Å; D591-S594 PolarHBondContact OD1-N 3.48Å
592	L	71.2	Confident	62.1	Low	14 Å²	14	88.6 Å²	88.6	7%	0.073	47%	0.472	C	S	.	.	H	α-helix	trans	-55.9	-26.9	176.7	-162.7	75.8	0	0	0	112.4	Y43 Y215 E218 Y590 S594 L595 Y596	Y43-L592 HydrophobicContact CD1-CD2 4.11Å; Y43-L592 HydrophobicContact CE1-CD2 3.8Å; Y215-L592 HydrophobicContact CD2-CD1 4.39Å; Y215-L592 HydrophobicContact CE2-CD1 4.16Å; E218-L592 HydrophobicContact CB-CD1 3.67Å; E218-L592 HydrophobicContact CB-CD2 3.91Å; E218-L592 HydrophobicContact CB-CG 4.47Å; Y590-L592 VanDerWaalsContact C-N 3.35Å; Y590-L592 PolarHBondContact O-N 2.99Å; L592-S594 VanDerWaalsContact C-N 3.31Å; L592-S594 PolarHBondContact O-N 2.78Å; L592-L595 HydrophobicContact CD1-CD1 4.37Å; L592-L595 PolarHBondContact O-N 3.32Å; L592-Y596 PolarHBondContact O-N 3.23Å
593	M	72.9	Confident	63.5	Low	54 Å²	54	86.7 Å²	86.7	27%	0.266	46%	0.457	S	S	.	.	H	α-helix	trans	-74.5	-22.3	178.3	-59.7	-48.9	-68.8	0	0	112.7	L45 L46 D591 L595 Y596	L45-M593 HydrophobicContact CB-CE 4.09Å; L45-M593 HydrophobicContact CB-SD 3.63Å; L45-M593 HydrophobicContact CD1-CG 4.3Å; L45-M593 HydrophobicContact CD1-SD 3.71Å; L45-M593 HydrophobicContact CG-SD 3.82Å; L46-M593 HydrophobicContact CB-CE 3.81Å; L46-M593 HydrophobicContact CD1-CE 3.66Å; L46-M593 HydrophobicContact CG-CE 3.73Å; D591-M593 PolarHBondContact O-N 3.14Å; D591-M593 VanDerWaalsContact O-N 3.14Å; D591-M593 WeakPolarHBondContact OD1-CB 3.4Å; D591-M593 PolarHBondContact OD1-N 3.42Å; D591-M593 VanDerWaalsContact OD1-N 3.11Å; M593-L595 VanDerWaalsContact C-N 3.28Å; M593-Y596 PolarHBondContact O-N 3.09Å
594	S	78.7	Confident	64.9	Low	86 Å²	86	85.1 Å²	85.1	60%	0.601	45%	0.445	S	S	*	.	H	α-helix	trans	-71.3	-22.4	170.8	75.1	0	0	0	0	113.5	D591 L592	D591-S594 WeakPolarHBondContact O-CB 3.4Å; D591-S594 PolarHBondContact O-N 3.47Å; D591-S594 PolarHBondContact O-OG 2.86Å; D591-S594 PolarHBondContact OD1-N 3.48Å; L592-S594 VanDerWaalsContact C-N 3.31Å; L592-S594 PolarHBondContact O-N 2.78Å
595	L	79.4	Confident	66.6	Low	54 Å²	54	78.8 Å²	78.8	28%	0.283	41%	0.411	S	S	.	.	H	α-helix	trans	-83.2	-20.3	174.7	-68.6	178.2	0	0	0	113	Y215 T222 N226 L592 M593 N597	Y215-L595 HydrophobicContact CE2-CD1 4.41Å; Y215-L595 WeakPolarHBondContact OH-CD1 3.4Å; T222-L595 HydrophobicContact CG2-CB 3.95Å; N226-L595 PolarHBondContact ND2-O 3.23Å; L592-L595 HydrophobicContact CD1-CD1 4.37Å; L592-L595 PolarHBondContact O-N 3.32Å; M593-L595 VanDerWaalsContact C-N 3.28Å; L595-N597 PolarHBondContact O-N 2.83Å
596	Y	86.9	Confident	68.2	Low	31 Å²	31	76 Å²	76	12%	0.122	40%	0.396	C	S	.	.			trans	-83.9	104.3	-179.5	-168.9	-119.9	0	0	0	111	P44 H48 T222 L225 N226 L592 M593 P598	P44-Y596 HydrophobicContact CB-CD1 3.61Å; P44-Y596 HydrophobicContact CB-CD2 4.33Å; P44-Y596 HydrophobicContact CB-CE1 3.4Å; P44-Y596 HydrophobicContact CB-CE2 4.2Å; P44-Y596 HydrophobicContact CB-CG 4.07Å; P44-Y596 HydrophobicContact CG-CD1 4.3Å; P44-Y596 HydrophobicContact CG-CE1 3.57Å; P44-Y596 HydrophobicContact CG-CE2 4.47Å; H48-Y596 AromaticContact CE1-CE1 3.91Å; H48-Y596 AromaticContact CE1-CZ 3.94Å; H48-Y596 PolarHBondContact CE1-OH 2.75Å; H48-Y596 PolarHBondContact NE2-OH 3.08Å; T222-Y596 HydrophobicContact CG2-CD2 3.99Å; T222-Y596 HydrophobicContact CG2-CG 4.39Å; L225-Y596 HydrophobicContact CB-CD2 4.38Å; L225-Y596 HydrophobicContact CB-CE2 3.7Å; N226-Y596 VanDerWaalsContact OD1-CD2 3.27Å; N226-Y596 WeakPolarHBondContact OD1-CD2 3.42Å; L592-Y596 PolarHBondContact O-N 3.23Å; M593-Y596 PolarHBondContact O-N 3.09Å; Y596-P598 HydrophobicContact CD1-CG 4.26Å; Y596-P598 HydrophobicContact CE1-CB 4.34Å; Y596-P598 HydrophobicContact CE1-CG 3.58Å; Y596-P598 HydrophobicContact CE2-CB 4.14Å; Y596-P598 HydrophobicContact CE2-CG 4.2Å
597	N	86.1	Confident	69.7	Low	123 Å²	123	73.5 Å²	73.5	66%	0.658	38%	0.377	S	S	*	.			trans	-136.1	73.9	178.6	-173.8	24.1	0	0	0	109.2	N226 L595	N226-N597 VanDerWaalsContact OD1-C 3.31Å; N226-N597 PolarHBondContact OD1-N 2.75Å; L595-N597 PolarHBondContact O-N 2.83Å
598	P	85	Confident	70.8	Confident	12 Å²	12	71.1 Å²	71.1	8%	0.078	37%	0.365	C	S	.	.			trans	-66.2	146.3	-178.2	28.1	-34.9	0	0	0	110.4	R13 Y596 Q600	R13-P598 HydrophobicContact CG-CB 4.04Å; Y596-P598 HydrophobicContact CD1-CG 4.26Å; Y596-P598 HydrophobicContact CE1-CB 4.34Å; Y596-P598 HydrophobicContact CE1-CG 3.58Å; Y596-P598 HydrophobicContact CE2-CB 4.14Å; Y596-P598 HydrophobicContact CE2-CG 4.2Å; P598-Q600 PolarHBondContact O-N 3.43Å; P598-Q600 PolarHBondContact O-NE2 3.4Å
599	P	83.1	Confident	71.5	Confident	22 Å²	22	67.5 Å²	67.5	14%	0.143	35%	0.348	C	S	.	.			trans	-59.7	137.4	177.5	26.6	-35.5	0	0	0	110.8	P12 P228 L605	P12-P599 HydrophobicContact CB-CB 4.23Å; P12-P599 HydrophobicContact CB-CG 4.32Å; P12-P599 WeakPolarHBondContact CG-O 3.43Å; P12-P599 VanDerWaalsContact O-CG 3.3Å; P12-P599 WeakPolarHBondContact O-CG 3.39Å; P228-P599 HydrophobicContact CB-CG 4.23Å; P599-L605 HydrophobicContact CB-CD2 3.83Å
600	Q	78.7	Confident	72	Confident	145 Å²	145	65.3 Å²	65.3	68%	0.678	34%	0.338	S	S	*	.			trans	-104.3	-27.9	-172.8	-60.5	-63.6	-47.4	0	0	113.6	P598	P598-Q600 PolarHBondContact O-N 3.43Å; P598-Q600 PolarHBondContact O-NE2 3.4Å
601	N	78.2	Confident	71.3	Confident	74 Å²	74	66.5 Å²	66.5	40%	0.396	35%	0.347	S	S	.	.			trans	-144.4	143.4	-178.7	-172.1	3.3	0	0	0	111.2	D603	N601-D603 VanDerWaalsContact C-N 3.34Å; N601-D603 PolarHBondContact ND2-OD2 2.9Å; N601-D603 PolarHBondContact O-N 3.13Å; N601-D603 PolarHBondContact OD1-N 3.18Å
602	M	71.2	Confident	70.1	Confident	32 Å²	32	67.5 Å²	67.5	16%	0.158	36%	0.357	C	S	.	.	H	α-helix	trans	-65.6	-31.5	178.6	-64.6	-67.4	-80.7	0	0	113	Y10 P12 V229 I231 D604 L605 L606	Y10-M602 HydrophobicContact CD1-CE 3.81Å; Y10-M602 HydrophobicContact CG-CE 4.28Å; P12-M602 HydrophobicContact CB-SD 4.01Å; V229-M602 HydrophobicContact CG1-CE 3.84Å; V229-M602 HydrophobicContact CG1-SD 3.65Å; I231-M602 HydrophobicContact CB-CE 4.24Å; I231-M602 HydrophobicContact CD1-CE 4.46Å; I231-M602 HydrophobicContact CG1-CE 3.74Å; I231-M602 HydrophobicContact CG2-CE 4.19Å; M602-D604 VanDerWaalsContact C-N 3.29Å; M602-D604 PolarHBondContact O-N 3.46Å; M602-L605 WeakPolarHBondContact O-CB 3.47Å; M602-L605 PolarHBondContact O-N 2.71Å; M602-L605 HydrophobicContact SD-CD1 3.9Å; M602-L606 PolarHBondContact O-N 2.96Å; M602-L606 VanDerWaalsContact O-N 3.14Å
603	D	69.4	Low	68.2	Low	92 Å²	92	75.6 Å²	75.6	49%	0.492	39%	0.394	S	S	.	.	H	α-helix	trans	-62.3	-36.3	179.6	-70.3	-40.8	0	0	0	112.9	N601 L606 K607	N601-D603 VanDerWaalsContact C-N 3.34Å; N601-D603 PolarHBondContact ND2-OD2 2.9Å; N601-D603 PolarHBondContact O-N 3.13Å; N601-D603 PolarHBondContact OD1-N 3.18Å; D603-L606 PolarHBondContact O-N 2.82Å; D603-K607 WeakPolarHBondContact O-CG 3.44Å; D603-K607 PolarHBondContact O-N 3.18Å
604	D	69.3	Low	66.1	Low	74 Å²	74	81 Å²	81	40%	0.396	42%	0.419	S	S	.	.	H	α-helix	trans	-75.5	-29.7	179.6	-66.5	-30.3	0	0	0	111.3	M602 L606 K607 N608	M602-D604 VanDerWaalsContact C-N 3.29Å; M602-D604 PolarHBondContact O-N 3.46Å; D604-L606 VanDerWaalsContact C-N 3.34Å; D604-K607 PolarHBondContact O-N 2.95Å; D604-K607 IonicContact OD1-NZ 3.27Å; D604-K607 PolarHBondContact OD1-NZ 2.7Å; D604-N608 VanDerWaalsContact O-CB 3.29Å; D604-N608 WeakPolarHBondContact O-CB 3.48Å; D604-N608 PolarHBondContact O-N 3.29Å; D604-N608 PolarHBondContact O-ND2 3.49Å
605	L	67.1	Low	63.8	Low	15 Å²	15	85.5 Å²	85.5	8%	0.079	42%	0.424	C	S	.	.	H	α-helix	trans	-61.4	-44	169.1	-57.8	-177.3	0	0	0	111.1	P12 P228 V229 I231 P599 M602 N608 A609	P12-L605 HydrophobicContact CB-CD1 4.3Å; P228-L605 HydrophobicContact CB-CD1 3.84Å; P228-L605 HydrophobicContact CB-CD2 3.42Å; P228-L605 VanDerWaalsContact CB-CD2 3.42Å; P228-L605 HydrophobicContact CB-CG 4.24Å; P228-L605 HydrophobicContact CG-CD2 4.3Å; V229-L605 HydrophobicContact CG1-CD1 4.48Å; I231-L605 HydrophobicContact CD1-CB 4.45Å; P599-L605 HydrophobicContact CB-CD2 3.83Å; M602-L605 WeakPolarHBondContact O-CB 3.47Å; M602-L605 PolarHBondContact O-N 2.71Å; M602-L605 HydrophobicContact SD-CD1 3.9Å; L605-N608 PolarHBondContact O-N 2.9Å; L605-A609 VanDerWaalsContact O-CB 3.25Å; L605-A609 WeakPolarHBondContact O-CB 3.43Å; L605-A609 PolarHBondContact O-N 2.86Å
606	L	67.4	Low	61.4	Low	55 Å²	55	91.8 Å²	91.8	29%	0.288	45%	0.454	S	S	.	.	H	α-helix	trans	-64.4	-43.5	178.4	-130.3	161.4	0	0	0	111.7	I231 K234 M602 D603 D604 N608 A609 I610	I231-L606 HydrophobicContact CD1-CB 3.94Å; I231-L606 HydrophobicContact CD1-CD1 3.77Å; I231-L606 HydrophobicContact CD1-CG 3.66Å; K234-L606 HydrophobicContact CD-CD1 4.34Å; M602-L606 PolarHBondContact O-N 2.96Å; M602-L606 VanDerWaalsContact O-N 3.14Å; D603-L606 PolarHBondContact O-N 2.82Å; D604-L606 VanDerWaalsContact C-N 3.34Å; L606-N608 PolarHBondContact O-N 3.42Å; L606-A609 PolarHBondContact O-N 3.01Å; L606-I610 HydrophobicContact CD2-CD1 3.66Å; L606-I610 HydrophobicContact CD2-CG1 4.43Å; L606-I610 WeakPolarHBondContact O-CD1 3.42Å; L606-I610 WeakPolarHBondContact O-CG1 3.34Å; L606-I610 PolarHBondContact O-N 3.12Å
607	K	68.4	Low	58.5	Low	109 Å²	109	101.5 Å²	101.5	47%	0.474	49%	0.491	S	S	.	.	H	α-helix	trans	-61.3	-41.9	174.1	-67.9	166.5	-154.2	157	0	112.2	D603 D604 Q611	D603-K607 WeakPolarHBondContact O-CG 3.44Å; D603-K607 PolarHBondContact O-N 3.18Å; D604-K607 PolarHBondContact O-N 2.95Å; D604-K607 IonicContact OD1-NZ 3.27Å; D604-K607 PolarHBondContact OD1-NZ 2.7Å; K607-Q611 WeakPolarHBondContact O-CG 3.39Å; K607-Q611 PolarHBondContact O-N 3.47Å
608	N	61.7	Low	55.7	Low	104 Å²	104	103.8 Å²	103.8	56%	0.556	50%	0.495	S	S	*	.	H	α-helix	trans	-73	-37.9	-178.8	-68.8	-19.6	0	0	0	111.8	D604 L605 L606 I610 Q611 P612	D604-N608 VanDerWaalsContact O-CB 3.29Å; D604-N608 WeakPolarHBondContact O-CB 3.48Å; D604-N608 PolarHBondContact O-N 3.29Å; D604-N608 PolarHBondContact O-ND2 3.49Å; L605-N608 PolarHBondContact O-N 2.9Å; L606-N608 PolarHBondContact O-N 3.42Å; N608-I610 VanDerWaalsContact C-N 3.27Å; N608-I610 PolarHBondContact O-N 2.98Å; N608-Q611 PolarHBondContact O-N 3.12Å; N608-P612 VanDerWaalsContact O-CD 3.26Å; N608-P612 WeakPolarHBondContact O-CD 3.31Å
609	A	58.1	Low	52.9	Low	11 Å²	11	110.9 Å²	110.9	9%	0.091	53%	0.532	C	S	.	.	H	α-helix	trans	-63.3	-28.2	176.2	0	0	0	0	0	113.7	T235 I537 L605 L606 P612	T235-A609 HydrophobicContact CG2-CB 4.07Å; I537-A609 HydrophobicContact CD1-CB 3.96Å; I537-A609 HydrophobicContact CG1-CB 3.63Å; L605-A609 VanDerWaalsContact O-CB 3.25Å; L605-A609 WeakPolarHBondContact O-CB 3.43Å; L605-A609 PolarHBondContact O-N 2.86Å; L606-A609 PolarHBondContact O-N 3.01Å; A609-P612 WeakPolarHBondContact O-CD 3.46Å
610	I	54.8	Low	50.1	Low	109 Å²	109	119.3 Å²	119.3	56%	0.559	57%	0.566	S	S	*	*	H	α-helix	trans	-84.2	-23.4	179.3	-67.1	167.8	0	0	0	112.3	L606 N608 P612	L606-I610 HydrophobicContact CD2-CD1 3.66Å; L606-I610 HydrophobicContact CD2-CG1 4.43Å; L606-I610 WeakPolarHBondContact O-CD1 3.42Å; L606-I610 WeakPolarHBondContact O-CG1 3.34Å; L606-I610 PolarHBondContact O-N 3.12Å; N608-I610 VanDerWaalsContact C-N 3.27Å; N608-I610 PolarHBondContact O-N 2.98Å; I610-P612 VanDerWaalsContact C-CD 3.47Å
611	Q	43.6	Very low	47.9	Very low	112 Å²	112	118.2 Å²	118.2	52%	0.523	57%	0.572	S	S	.	*	G	3₁₀ helix	trans	-72.8	-22.6	-174.3	-77.9	-175.8	43.3	0	0	118	K607 N608 Q613 Q614	K607-Q611 WeakPolarHBondContact O-CG 3.39Å; K607-Q611 PolarHBondContact O-N 3.47Å; N608-Q611 PolarHBondContact O-N 3.12Å; Q611-Q613 PolarHBondContact O-N 3.23Å; Q611-Q614 PolarHBondContact O-N 3.45Å
612	P	40.2	Very low	45.7	Very low	90 Å²	90	124.8 Å²	124.8	58%	0.584	60%	0.597	S	S	*	*	G	3₁₀ helix	trans	-80.6	30.2	177	34.1	-35.3	0	0	0	114.5	N608 A609 I610	N608-P612 VanDerWaalsContact O-CD 3.26Å; N608-P612 WeakPolarHBondContact O-CD 3.31Å; A609-P612 WeakPolarHBondContact O-CD 3.46Å; I610-P612 VanDerWaalsContact C-CD 3.47Å
613	Q	32.5	Very low	43.6	Very low	184 Å²	184	134.6 Å²	134.6	86%	0.86	63%	0.632	S	S	*	*	G	3₁₀ helix	trans	-118.3	-11.8	164	-71.8	-160.8	-6.9	0	0	115.2	Q611	Q611-Q613 PolarHBondContact O-N 3.23Å
614	Q	28.3	Very low	41.7	Very low	168 Å²	168	141.9 Å²	141.9	79%	0.785	65%	0.653	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.2	-12.9	-177	-65.4	-164.1	-1	0	0	115.5	Q611	Q611-Q614 PolarHBondContact O-N 3.45Å
615	Y	29.5	Very low	39.9	Very low	180 Å²	180	143.4 Å²	143.4	71%	0.706	67%	0.667	S	S	*	*	S	Bend	trans	-89.2	-4.6	-178.9	-92.9	-83.2	0	0	0	116.1	R617	Y615-R617 VanDerWaalsContact C-N 3.3Å; Y615-R617 PolarHBondContact O-N 2.96Å
616	M	29	Very low	38.2	Very low	186 Å²	186	149 Å²	149	92%	0.916	70%	0.697	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.8	26.8	172.7	-80.8	-65.5	-152.2	0	0	114.5
617	R	27.4	Very low	36.4	Very low	235 Å²	235	154 Å²	154	89%	0.887	72%	0.719	S	S	*	*	T	Hydrogen-bonded Turn	trans	-131.2	10.7	177.1	-92.6	-175.5	177.8	172.9	1.6	116.5	Y615	Y615-R617 VanDerWaalsContact C-N 3.3Å; Y615-R617 PolarHBondContact O-N 2.96Å
618	K	26.2	Very low	34.5	Very low	171 Å²	171	155.9 Å²	155.9	74%	0.743	73%	0.729	S	S	*	*			trans	-122.9	51.6	177.7	-73.1	-175.4	-179.4	171.1	0	114.5
619	N	27.2	Very low	33	Very low	161 Å²	161	158.5 Å²	158.5	86%	0.861	74%	0.738	S	S	*	*			trans	-141	76.4	157.5	-92.3	-33.6	0	0	0	110.5	P621	N619-P621 WeakPolarHBondContact O-CD 3.4Å
620	K	25	Very low	31.6	Very low	198 Å²	198	164.1 Å²	164.1	86%	0.861	77%	0.766	S	S	*	*			trans	-95.7	106	168.4	-96.3	-179.8	171.9	173.1	0	109.3
621	P	31.5	Very low	30.3	Very low	123 Å²	123	167.5 Å²	167.5	80%	0.799	78%	0.779	S	S	*	*			trans	-68.8	133.7	169	28.7	-32.7	0	0	0	109.9	N619 R623	N619-P621 WeakPolarHBondContact O-CD 3.4Å; P621-R623 PolarHBondContact O-N 3.26Å
622	K	31.7	Very low	29.7	Very low	211 Å²	211	167.3 Å²	167.3	92%	0.917	79%	0.788	S	S	*	*			trans	-76.5	109.7	176.4	-81.6	-179.6	176	174.5	0	110.6
623	R	27.3	Very low	28.9	Very low	239 Å²	239	169 Å²	169	90%	0.902	80%	0.797	S	S	*	*			trans	31.7	126.2	147.9	-74.1	179.9	167.2	169.9	-4.5	118.6	P621	P621-R623 PolarHBondContact O-N 3.26Å
624	R	29.8	Very low	28.5	Very low	245 Å²	245	167 Å²	167	93%	0.925	79%	0.792	S	S	*	*				-148.5	157.1	110.6	-105.2	174	-170.9	-169.8	2.5	110.7
625	P	31.4	Very low	28.4	Very low	105 Å²	105	164.6 Å²	164.6	68%	0.682	79%	0.794	S	S	*	*			trans	-108.3	151.7	-160.2	39.2	-32.9	0	0	0	115.3
626	N	30.4	Very low	28.1	Very low	134 Å²	134	165.2 Å²	165.2	72%	0.717	80%	0.8	S	S	*	*			trans	159.3	123.1	137.8	-80.8	-6.8	0	0	0	108.1
627	Q	30.4	Very low	28	Very low	160 Å²	160	163.9 Å²	163.9	75%	0.748	80%	0.797	S	S	*	*				50.8	127.1	104.4	-61.2	-176.2	0.7	0	0	113.8
628	Q	28.9	Very low	27.9	Very low	147 Å²	147	159.6 Å²	159.6	69%	0.687	79%	0.791	S	S	*	*			cis	-165.1	157.4	7.1	-113.6	168	0.7	0	0	110.1
629	Q	29.7	Very low	28	Very low	159 Å²	159	158.5 Å²	158.5	74%	0.743	80%	0.798	S	S	*	*			trans	67.6	128.1	147.7	-72.8	178.9	-3.6	0	0	124
630	L	29.6	Very low	27.9	Very low	130 Å²	130	158.7 Å²	158.7	68%	0.681	80%	0.799	S	S	*	*			trans	74.8	100.7	131.5	-70.5	164.5	0	0	0	122.8
631	Q	27.2	Very low	28.1	Very low	180 Å²	180	154.3 Å²	154.3	84%	0.841	80%	0.801	S	S	*	*			trans	66.6	154.1	130.4	-75.4	-169.1	16.5	0	0	122.1
632	P	30.6	Very low	27.8	Very low	108 Å²	108	157 Å²	157	70%	0.701	80%	0.803	S	S	*	*			trans	-113.7	159.6	-163.5	41.1	-30.1	0	0	0	114.6
633	T	24.2	Very low	27.6	Very low	125 Å²	125	151.6 Å²	151.6	77%	0.767	79%	0.787	S	S	*	*			trans	-171.4	136	134.1	26.9	0	0	0	0	112.1
634	D	23.1	Very low	27.6	Very low	143 Å²	143	147 Å²	147	77%	0.765	78%	0.776	S	S	*	*			trans	40.2	144.5	135.4	-51	-26	0	0	0	125
635	S	26.1	Very low	27.4	Very low	117 Å²	117	142.7 Å²	142.7	82%	0.818	76%	0.764	S	S	*	*			trans	103.4	136	141.4	74.7	0	0	0	0	120.5
636	F	23.9	Very low	27.2	Very low	192 Å²	192	143.9 Å²	143.9	84%	0.842	77%	0.769	S	S	*	*			trans	-52.4	147.9	-179.1	-68.4	-105.8	0	0	0	115.2
637	D	27	Very low	27	Very low	159 Å²	159	143.6 Å²	143.6	85%	0.85	77%	0.768	S	S	*	*				-167.9	154.5	101.4	-114.4	-25.4	0	0	0	114.3
638	L	25	Very low	26.9	Very low	145 Å²	145	141.5 Å²	141.5	76%	0.759	77%	0.77	S	S	*	*			trans	-88.2	146.9	170.6	-94.7	77.4	0	0	0	111
639	T	28.4	Very low	26.9	Very low	147 Å²	147	140.5 Å²	140.5	90%	0.902	77%	0.768	S	S	*	*				-168.5	150.3	127.7	17	0	0	0	0	112.7
640	N	25.5	Very low	26.9	Very low	165 Å²	165	141.8 Å²	141.8	88%	0.882	77%	0.774	S	S	*	*			trans	-80.8	145.3	-175.3	-70.5	-54.4	0	0	0	113.5
641	A	28.6	Very low	26.8	Very low	107 Å²	107	141.5 Å²	141.5	88%	0.884	77%	0.774	S	S	*	*			trans	-145	136.1	145	0	0	0	0	0	110.4
642	Q	25.7	Very low	26.8	Very low	180 Å²	180	138.5 Å²	138.5	84%	0.841	76%	0.764	S	S	*	*			trans	-104	167.8	-169.1	-126.4	-174.4	12.4	0	0	111.7
643	V	27.3	Very low	26.7	Very low	97 Å²	97	140.5 Å²	140.5	59%	0.588	76%	0.763	S	S	*	*			trans	92.2	109.3	137.9	144.1	0	0	0	0	120.6
644	Q	26.5	Very low	26.9	Very low	143 Å²	143	141 Å²	141	67%	0.668	76%	0.76	S	S	*	*			trans	74.7	151.5	135.3	-65	-174.7	70	0	0	120.1
645	K	25.4	Very low	27.2	Very low	154 Å²	154	138.6 Å²	138.6	67%	0.67	76%	0.76	S	S	*	*			cis	-168.5	179.7	-19.3	-118.9	177.6	-166.7	162	0	109.5
646	T	28.2	Very low	27.2	Very low	130 Å²	130	140 Å²	140	80%	0.798	76%	0.758	S	S	*	*			trans	102.3	143.1	157.6	70.8	0	0	0	0	116.1
647	N	24.6	Very low	27.4	Very low	128 Å²	128	136.6 Å²	136.6	68%	0.684	75%	0.748	S	S	*	*			cis	158.4	119.9	-36.3	-98.5	19	0	0	0	107.3
648	S	29.6	Very low	27.4	Very low	115 Å²	115	137.2 Å²	137.2	80%	0.804	74%	0.743	S	S	*	*			trans	-179	114.1	148.4	16.4	0	0	0	0	105.4
649	I	28.1	Very low	27.5	Very low	126 Å²	126	139.6 Å²	139.6	65%	0.646	75%	0.747	S	S	*	*			cis	73.9	102.9	45.8	-52.7	172.9	0	0	0	112.3
650	E	29.3	Very low	27.5	Very low	186 Å²	186	138 Å²	138	87%	0.869	74%	0.742	S	S	*	*				168.4	155.5	129.3	-93.4	-179.9	-169.9	0	0	108.9
651	N	28.3	Very low	27.5	Very low	125 Å²	125	137.6 Å²	137.6	67%	0.668	74%	0.739	S	S	*	*				-169.9	142.3	-66.6	-105.9	-4.7	0	0	0	106.4
652	N	28.1	Very low	27.5	Very low	117 Å²	117	138.6 Å²	138.6	63%	0.626	74%	0.736	S	S	*	*			trans	69.1	114.5	143.4	-68.2	26.1	0	0	0	123.4
653	E	27.7	Very low	27.4	Very low	149 Å²	149	133.1 Å²	133.1	70%	0.696	73%	0.729	S	S	*	*				124.5	132.6	98.3	-91.9	177	-157.4	0	0	122.9
654	I	27.9	Very low	27.3	Very low	137 Å²	137	140 Å²	140	70%	0.703	74%	0.744	S	S	*	*			trans	73.2	113.7	142.6	-60.9	160.8	0	0	0	122
655	A	29.4	Very low	27.1	Very low	92 Å²	92	140.1 Å²	140.1	76%	0.76	75%	0.748	S	S	*	*				166.3	114.3	117.7	0	0	0	0	0	110.7
656	L	27.8	Very low	27.1	Very low	147 Å²	147	140.8 Å²	140.8	77%	0.77	76%	0.758	S	S	*	*				69.5	116.7	75.2	-89.9	161.1	0	0	0	118.2
657	N	26.6	Very low	26.7	Very low	120 Å²	120	140 Å²	140	64%	0.642	75%	0.754	S	S	*	*			trans	88.3	110.4	144.7	-78.1	-36.6	0	0	0	123.6
658	K	26.8	Very low	26.7	Very low	171 Å²	171	141.3 Å²	141.3	74%	0.743	76%	0.759	S	S	*	*				121	142.3	101.3	-94.3	173.6	-174.3	175.1	0	120.4
659	K	28.1	Very low	26.7	Very low	195 Å²	195	141.1 Å²	141.1	85%	0.848	76%	0.755	S	S	*	*			trans	79.7	139.6	163.7	-65.4	167.5	-179.7	-178	0	116.5
660	S	27.8	Very low	26.5	Very low	113 Å²	113	140.3 Å²	140.3	79%	0.79	76%	0.761	S	S	*	*			cis	-164.9	146.6	-3.2	41.4	0	0	0	0	113.4
661	L	25.2	Very low	26.4	Very low	158 Å²	158	139.9 Å²	139.9	83%	0.827	76%	0.761	S	S	*	*			trans	-73.5	167.3	159.6	-109.7	91.8	0	0	0	111.1
662	P	29.3	Very low	26.2	Very low	127 Å²	127	137.6 Å²	137.6	83%	0.825	76%	0.76	S	S	*	*				-142.6	-174.9	50.9	37.4	-15.3	0	0	0	115.2
663	G	23.3	Very low	26.2	Very low	66 Å²	66	141.3 Å²	141.3	68%	0.68	77%	0.773	S	S	*	*			cis	135	105.2	-5.6	0	0	0	0	0	114.8
664	R	25.3	Very low	26	Very low	241 Å²	241	139.2 Å²	139.2	91%	0.909	78%	0.775	S	S	*	*			trans	-176.6	128.1	157.1	-129.1	176.1	170.8	159.4	-3.3	107.1
665	L	22.7	Very low	26	Very low	145 Å²	145	139 Å²	139	76%	0.759	78%	0.78	S	S	*	*			cis	73.9	94.6	40.9	-136.2	178.9	0	0	0	113.6
666	L	25.8	Very low	25.7	Very low	168 Å²	168	139.3 Å²	139.3	88%	0.88	78%	0.777	S	S	*	*			trans	-162.7	157	145	-105.7	171.1	0	0	0	110.3
667	T	20	Very low	25.7	Very low	114 Å²	114	140.2 Å²	140.2	70%	0.699	78%	0.783	S	S	*	*			trans	-136.3	164.1	-170.2	-37.5	0	0	0	0	109.4
668	I	23.9	Very low	25.6	Very low	156 Å²	156	139.3 Å²	139.3	80%	0.8	79%	0.785	S	S	*	*			trans	72.1	164.3	167	-9.7	-176.6	0	0	0	115.1
669	P	30	Very low	25.8	Very low	110 Å²	110	136 Å²	136	71%	0.714	78%	0.784	S	S	*	*				-126.4	-177.9	-88.5	42.4	-28.8	0	0	0	115.8
670	S	23.8	Very low	25.7	Very low	109 Å²	109	133.5 Å²	133.5	76%	0.762	78%	0.78	S	S	*	*			trans	40.9	105.5	142.1	-173.5	0	0	0	0	119.8
671	M	26.2	Very low	25.8	Very low	177 Å²	177	135.8 Å²	135.8	87%	0.872	78%	0.783	S	S	*	*			trans	-147.3	128.7	130.2	-69.6	-151.5	78.1	0	0	105.7
672	A	23.8	Very low	25.9	Very low	78 Å²	78	136.6 Å²	136.6	65%	0.645	78%	0.783	S	S	*	*				69.3	80.3	61.9	0	0	0	0	0	112.5
673	E	28.6	Very low	25.9	Very low	194 Å²	194	137.7 Å²	137.7	91%	0.907	78%	0.782	S	S	*	*			trans	-114.6	97.3	149.2	-93.2	-179.7	167	0	0	108.2
674	S	23.1	Very low	26.1	Very low	105 Å²	105	142.5 Å²	142.5	73%	0.734	79%	0.792	S	S	*	*			trans	-79	115.2	163.3	47.7	0	0	0	0	109
675	T	28.5	Very low	26.3	Very low	133 Å²	133	136.4 Å²	136.4	82%	0.816	79%	0.786	S	S	*	*			trans	-107.4	84.3	156.8	53.4	0	0	0	0	108.1	D677	T675-D677 PolarHBondContact O-N 3.23Å
676	S	24	Very low	26.7	Very low	99 Å²	99	137 Å²	137	69%	0.692	79%	0.79	S	S	*	*			trans	-72.5	100.3	158.6	49	0	0	0	0	108.3
677	D	27.3	Very low	26.9	Very low	166 Å²	166	135.9 Å²	135.9	89%	0.888	78%	0.783	S	S	*	*			trans	-92.1	94.3	151.7	-85.6	-30.1	0	0	0	107	T675	T675-D677 PolarHBondContact O-N 3.23Å
678	S	24.9	Very low	27.3	Very low	100 Å²	100	141.8 Å²	141.8	70%	0.699	79%	0.793	S	S	*	*			trans	-85.1	114.7	160.2	51.6	0	0	0	0	107.9
679	S	30.1	Very low	27.7	Very low	103 Å²	103	140.2 Å²	140.2	72%	0.72	79%	0.786	S	S	*	*			trans	-118.9	112.4	156.4	59.1	0	0	0	0	107.6	D681	S679-D681 PolarHBondContact O-N 3.08Å; S679-D681 VanDerWaalsContact O-N 3.13Å
680	D	26.5	Very low	27.5	Very low	142 Å²	142	143.2 Å²	143.2	76%	0.759	80%	0.795	S	S	*	*			trans	-69.4	102.6	176.3	-62	-61.2	0	0	0	109.9
681	D	30	Very low	27.5	Very low	160 Å²	160	146.7 Å²	146.7	86%	0.856	80%	0.797	S	S	*	*			trans	-102	66.2	156.8	-80.1	-40.1	0	0	0	108	S679	S679-D681 PolarHBondContact O-N 3.08Å; S679-D681 VanDerWaalsContact O-N 3.13Å
682	Q	27.6	Very low	27.7	Very low	175 Å²	175	146 Å²	146	82%	0.818	80%	0.797	S	S	*	*			trans	-89.8	104.2	159.4	-76.9	-158.9	-33.2	0	0	108.7
683	D	28.9	Very low	27.8	Very low	151 Å²	151	147.7 Å²	147.7	81%	0.807	80%	0.804	S	S	*	*			trans	-176.7	163.2	137.6	-94.8	-22	0	0	0	109.5
684	D	27.9	Very low	27.8	Very low	167 Å²	167	144.9 Å²	144.9	89%	0.893	80%	0.8	S	S	*	*	S	Bend	trans	74.2	49.6	177.8	-63	-17.4	0	0	0	118.3
685	S	29.1	Very low	27.8	Very low	113 Å²	113	144.8 Å²	144.8	79%	0.79	80%	0.799	S	S	*	*			trans	-140.4	31.9	156.7	77	0	0	0	0	116.2
686	D	30.3	Very low	27.7	Very low	158 Å²	158	147.2 Å²	147.2	85%	0.845	80%	0.801	S	S	*	*			trans	-110	88.6	175.5	-86.3	-17	0	0	0	112.8
687	I	29.8	Very low	27.9	Very low	143 Å²	143	148.2 Å²	148.2	73%	0.733	81%	0.808	S	S	*	*	S	Bend	trans	-166.4	134.6	147	-102.7	156.1	0	0	0	105.7
688	W	30	Very low	27.8	Very low	238 Å²	238	147.9 Å²	147.9	90%	0.902	81%	0.806	S	S	*	*	S	Bend	trans	85.6	40.4	-170.9	-44.6	113.6	0	0	0	118.4
689	D	31.8	Very low	28	Very low	123 Å²	123	151.5 Å²	151.5	66%	0.658	82%	0.816	S	S	*	*			trans	-131.7	119.1	148.2	-94.3	-36.6	0	0	0	110.9	K88	K88-D689 IonicContact NZ-OD1 2.65Å; K88-D689 PolarHBondContact NZ-OD1 2.78Å; K88-D689 IonicContact NZ-OD2 3.9Å; K88-D689 PolarHBondContact NZ-OD2 2.79Å
690	L	24.8	Very low	27.8	Very low	173 Å²	173	155.8 Å²	155.8	91%	0.906	82%	0.822	S	S	*	*			trans	-142.5	56.1	175.5	-137.5	171.4	0	0	0	109.7
691	K	25.5	Very low	27.9	Very low	183 Å²	183	158.6 Å²	158.6	80%	0.796	83%	0.83	S	S	*	*			trans	-161.6	94.4	167.6	-131.1	-179.2	-177.1	-177.1	0	110.2
692	D	28.5	Very low	27.8	Very low	163 Å²	163	158.2 Å²	158.2	87%	0.872	83%	0.828	S	S	*	*			trans	164.1	79.8	135.3	-81.5	-6.9	0	0	0	112.2
693	S	25.9	Very low	28.1	Very low	112 Å²	112	155 Å²	155	78%	0.783	82%	0.822	S	S	*	*			trans	-118.3	128.7	145.1	61.5	0	0	0	0	105.1
694	V	29.1	Very low	28.2	Very low	136 Å²	136	154 Å²	154	82%	0.824	82%	0.817	S	S	*	*			cis	-150.4	142.4	49	167.2	0	0	0	0	110
695	S	24.2	Very low	28.3	Very low	103 Å²	103	154.6 Å²	154.6	72%	0.72	81%	0.814	S	S	*	*			trans	-135.8	142.2	150.3	74.8	0	0	0	0	111.1
696	Q	26.2	Very low	28.4	Very low	183 Å²	183	154.7 Å²	154.7	86%	0.855	81%	0.81	S	S	*	*			trans	74.3	105	173.1	-48.7	-173.3	20	0	0	118.8
697	S	27.9	Very low	28.5	Very low	120 Å²	120	152.9 Å²	152.9	84%	0.839	81%	0.805	S	S	*	*				-149.9	132.4	115.2	58.7	0	0	0	0	110.8
698	N	25.6	Very low	28.4	Very low	159 Å²	159	154 Å²	154	85%	0.85	81%	0.807	S	S	*	*			trans	-81.9	145.7	167.3	-74.4	-60.8	0	0	0	109
699	I	29.3	Very low	28.5	Very low	176 Å²	176	150.4 Å²	150.4	90%	0.903	80%	0.8	S	S	*	*			trans	-157.7	151.2	134.9	-101.7	146.4	0	0	0	110.2
700	K	25.6	Very low	28.4	Very low	194 Å²	194	150.6 Å²	150.6	84%	0.843	80%	0.801	S	S	*	*			trans	-72.9	148	-171.8	-57.1	153.6	177.3	171.4	0	112
701	E	28.4	Very low	28.7	Very low	201 Å²	201	148.6 Å²	148.6	94%	0.939	79%	0.791	S	S	*	*			trans	-151.8	144.6	134.3	-117.3	171.4	-143.8	0	0	110.8
702	N	27.8	Very low	29	Very low	152 Å²	152	146.7 Å²	146.7	81%	0.813	79%	0.787	S	S	*	*			trans	-157.9	127.5	-180	-161.8	16.3	0	0	0	105.6
703	P	33.9	Very low	29.2	Very low	106 Å²	106	147.2 Å²	147.2	69%	0.688	79%	0.786	S	S	*	*				-154	163.2	101.5	38.9	-21.4	0	0	0	116.8
704	N	31.2	Very low	29.4	Very low	132 Å²	132	151 Å²	151	71%	0.706	78%	0.783	S	S	*	*			trans	151.1	105.8	144.2	-74.7	-14.8	0	0	0	107.5
705	E	28.8	Very low	29.5	Very low	179 Å²	179	150.9 Å²	150.9	84%	0.836	78%	0.778	S	S	*	*				58.2	130.7	94.4	-69.4	-160.9	150	0	0	113.7
706	V	30.9	Very low	29.9	Very low	114 Å²	114	153.4 Å²	153.4	69%	0.691	78%	0.776	S	S	*	*			cis	-166.2	131	9.2	129.2	0	0	0	0	106.6
707	T	32.5	Very low	30.2	Very low	121 Å²	121	151.6 Å²	151.6	74%	0.742	78%	0.778	S	S	*	*				177.9	133.1	103.2	43.9	0	0	0	0	108.7
708	H	28.9	Very low	30.3	Very low	167 Å²	167	151.9 Å²	151.9	77%	0.773	77%	0.77	S	S	*	*				51.2	120.5	87	-86.8	-74.4	0	0	0	114.1
709	E	30.8	Very low	30.5	Very low	162 Å²	162	152.4 Å²	152.4	76%	0.757	77%	0.773	S	S	*	*			cis	-166.2	153.2	48.8	-105.3	162.7	-167.4	0	0	114.4
710	D	30.7	Very low	30.4	Very low	127 Å²	127	149.4 Å²	149.4	68%	0.679	76%	0.762	S	S	*	*			trans	71.8	117.7	135.8	-59.2	-0.9	0	0	0	127.7
711	D	31.5	Very low	30.6	Very low	131 Å²	131	147.9 Å²	147.9	70%	0.701	76%	0.763	S	S	*	*				94.2	109.2	122.3	-81	0.4	0	0	0	126.5
712	M	31	Very low	30.4	Very low	143 Å²	143	146.9 Å²	146.9	70%	0.704	76%	0.758	S	S	*	*				56.4	118.2	127.1	-57.8	-168.7	80.6	0	0	121.7
713	M	32.9	Very low	30.3	Very low	174 Å²	174	146.4 Å²	146.4	86%	0.857	76%	0.76	S	S	*	*				-166	170.1	92.9	-102	-62.3	-110.2	0	0	113.8
714	R	30.7	Very low	30	Very low	190 Å²	190	149.1 Å²	149.1	72%	0.717	76%	0.764	S	S	*	*			trans	-136.7	145.7	-149.9	-162.9	-168.3	-149.2	175.5	8.1	112.6
715	N	31.4	Very low	29.6	Very low	134 Å²	134	149.9 Å²	149.9	72%	0.717	77%	0.768	S	S	*	*			trans	142.4	109.1	143.7	-71.6	-27.6	0	0	0	111.3
716	K	31.5	Very low	29.6	Very low	156 Å²	156	149.4 Å²	149.4	68%	0.678	77%	0.769	S	S	*	*				78.2	116.5	69.1	-81.7	-171.4	170.7	-175	0	115.3
717	T	32.7	Very low	29.4	Very low	146 Å²	146	152.2 Å²	152.2	90%	0.896	78%	0.775	S	S	*	*				-156.1	152.8	114.1	15.7	0	0	0	0	110.1
718	N	29.8	Very low	29.1	Very low	126 Å²	126	154.6 Å²	154.6	67%	0.674	78%	0.783	S	S	*	*			trans	-104.9	159.9	-169.5	-56.2	-22.6	0	0	0	111.5
719	N	30.7	Very low	28.9	Very low	170 Å²	170	155.2 Å²	155.2	91%	0.909	78%	0.784	S	S	*	*				-158.1	155.1	113.5	-105	-17	0	0	0	113
720	V	27.1	Very low	28.7	Very low	112 Å²	112	155.6 Å²	155.6	68%	0.679	79%	0.79	S	S	*	*			trans	-123.9	150.5	-166.4	169.7	0	0	0	0	108.6
721	N	29.2	Very low	28.4	Very low	163 Å²	163	154 Å²	154	87%	0.872	79%	0.785	S	S	*	*			trans	-174.3	133.6	132	-90.7	-20	0	0	0	113.9
722	H	23.4	Very low	28	Very low	179 Å²	179	154.9 Å²	154.9	83%	0.829	79%	0.789	S	S	*	*			trans	-116.5	135.5	171.9	-124.4	-37.5	0	0	0	106.9
723	V	27.6	Very low	27.7	Very low	142 Å²	142	153.1 Å²	153.1	86%	0.861	79%	0.786	S	S	*	*			trans	-148.5	144.4	156.9	-179.7	0	0	0	0	109.5
724	Q	25.8	Very low	27.4	Very low	164 Å²	164	151.3 Å²	151.3	77%	0.766	78%	0.78	S	S	*	*			trans	-104.3	158.1	177.3	-66.1	173	-54.6	0	0	112.9
725	N	23.8	Very low	27.2	Very low	147 Å²	147	147.6 Å²	147.6	79%	0.786	78%	0.779	S	S	*	*			trans	35.9	125.7	146.9	-62.6	-1.3	0	0	0	121.9
726	I	29.5	Very low	27	Very low	170 Å²	170	145.9 Å²	145.9	87%	0.872	78%	0.777	S	S	*	*			trans	-140	135	133	-66.8	-169.3	0	0	0	108.9
727	E	25	Very low	26.9	Very low	173 Å²	173	145.4 Å²	145.4	81%	0.808	78%	0.782	S	S	*	*			trans	-81.3	159.9	173.8	-58.1	176.2	116.8	0	0	112.3
728	N	27.7	Very low	26.6	Very low	171 Å²	171	144.8 Å²	144.8	91%	0.914	78%	0.778	S	S	*	*			trans	-154.7	137.8	140	-108.4	-38.3	0	0	0	112.2
729	K	24.4	Very low	26.7	Very low	179 Å²	179	144.1 Å²	144.1	78%	0.778	78%	0.78	S	S	*	*			trans	-136.1	127.8	-170.1	177.9	-174.5	-173.4	177.1	0	107.9
730	L	26.5	Very low	26.6	Very low	171 Å²	171	143.4 Å²	143.4	90%	0.895	78%	0.775	S	S	*	*			trans	-156.7	159.6	164.6	-109.3	165.8	0	0	0	110.8
731	T	23.7	Very low	26.5	Very low	92 Å²	92	144.8 Å²	144.8	56%	0.564	78%	0.777	S	S	*	*			trans	-148.9	169.9	-143	45.6	0	0	0	0	112.8
732	L	23.2	Very low	26.4	Very low	151 Å²	151	147.3 Å²	147.3	79%	0.791	77%	0.774	S	S	*	*			trans	74.1	140	163.3	-57.6	145.3	0	0	0	114.5
733	T	24.5	Very low	26.5	Very low	106 Å²	106	147.3 Å²	147.3	65%	0.65	77%	0.772	S	S	*	*			cis	-177.3	167.8	18.2	6.8	0	0	0	0	110.7
734	N	27.5	Very low	26.4	Very low	136 Å²	136	146.6 Å²	146.6	73%	0.727	77%	0.77	S	S	*	*			trans	78.5	135.7	147.6	-71.5	2.7	0	0	0	120.9
735	T	26.1	Very low	26.5	Very low	112 Å²	112	143.6 Å²	143.6	69%	0.687	77%	0.767	S	S	*	*			cis	-169.7	167.2	-24.7	8.9	0	0	0	0	110.2
736	S	28.2	Very low	26.7	Very low	97 Å²	97	143.1 Å²	143.1	68%	0.678	76%	0.764	S	S	*	*			trans	88.5	107.5	145.3	73.9	0	0	0	0	121.1
737	N	28.9	Very low	26.5	Very low	146 Å²	146	147.2 Å²	147.2	78%	0.781	77%	0.768	S	S	*	*				115.1	94.3	116.3	-71.9	1.4	0	0	0	121.7
738	V	26.9	Very low	26.7	Very low	133 Å²	133	147.5 Å²	147.5	81%	0.806	77%	0.767	S	S	*	*				86.7	141.1	115.3	165.4	0	0	0	0	118.3
739	P	31.7	Very low	26.5	Very low	112 Å²	112	145.1 Å²	145.1	73%	0.727	76%	0.758	S	S	*	*			trans	-115.6	163	-151.8	40.8	-28.6	0	0	0	114.4
740	I	28.7	Very low	26.8	Very low	156 Å²	156	142.6 Å²	142.6	80%	0.8	76%	0.76	S	S	*	*			trans	-141.3	115.9	163.1	-87.4	144	0	0	0	111.2
741	I	23.9	Very low	26.7	Very low	140 Å²	140	140 Å²	140	72%	0.718	75%	0.752	S	S	*	*			trans	16.7	125.9	131.8	-32.9	172.5	0	0	0	118.2
742	R	26.8	Very low	27	Very low	216 Å²	216	141.7 Å²	141.7	82%	0.815	76%	0.762	S	S	*	*				159.1	111.8	126	-87.6	168.1	-171.1	-174	3.4	110.8
743	K	26.3	Very low	27.4	Very low	180 Å²	180	142.7 Å²	142.7	78%	0.783	76%	0.762	S	S	*	*				83.6	134.8	94.3	-79.6	-165	174.7	-163.7	0	113.8
744	P	26.3	Very low	27.5	Very low	127 Å²	127	146.4 Å²	146.4	83%	0.825	77%	0.772	S	S	*	*			trans	-67.6	151.2	167.9	31.3	-34.2	0	0	0	110.3
745	S	27.4	Very low	27.6	Very low	100 Å²	100	144.1 Å²	144.1	70%	0.699	77%	0.773	S	S	*	*			trans	-144.8	112.5	171.3	-95	0	0	0	0	112.3
746	L	27.6	Very low	27.7	Very low	137 Å²	137	144.9 Å²	144.9	72%	0.717	77%	0.772	S	S	*	*				49.5	92.1	111	-69.4	158.8	0	0	0	115.3	K748	L746-K748 VanDerWaalsContact C-N 3.33Å; L746-K748 PolarHBondContact O-N 3.27Å
747	R	26.2	Very low	27.8	Very low	257 Å²	257	150 Å²	150	97%	0.97	78%	0.778	S	S	*	*			trans	-63.7	94.5	156.7	-176.4	178.7	-75.2	176.8	-3	108.5
748	K	27.7	Very low	27.9	Very low	178 Å²	178	148 Å²	148	77%	0.774	77%	0.772	S	S	*	*			trans	-77.5	139.2	177.6	-80.1	-173.9	175.7	-178.9	0	112.3	L746	L746-K748 VanDerWaalsContact C-N 3.33Å; L746-K748 PolarHBondContact O-N 3.27Å
749	V	24.9	Very low	27.9	Very low	122 Å²	122	148.7 Å²	148.7	74%	0.739	77%	0.771	S	S	*	*			trans	-50.5	137	161.2	179.2	0	0	0	0	111.4
750	P	30.5	Very low	27.9	Very low	126 Å²	126	148.5 Å²	148.5	82%	0.818	77%	0.768	S	S	*	*			trans	-100.4	100.7	167.1	34.7	-27.1	0	0	0	111.7
751	T	24.2	Very low	27.9	Very low	117 Å²	117	148.7 Å²	148.7	72%	0.718	77%	0.765	S	S	*	*			trans	-149.1	105.9	166.1	-42.6	0	0	0	0	112.5
752	T	29	Very low	28.2	Very low	126 Å²	126	149 Å²	149	77%	0.773	77%	0.765	S	S	*	*			trans	-162.7	118.5	142.8	-27.6	0	0	0	0	111.4
753	Q	31.4	Very low	28.4	Very low	172 Å²	172	145.5 Å²	145.5	80%	0.804	76%	0.763	S	S	*	*				162.1	95.3	116.4	-84.4	-175.9	14.2	0	0	112.4
754	Q	27.6	Very low	28.4	Very low	184 Å²	184	146.3 Å²	146.3	86%	0.86	77%	0.766	S	S	*	*			trans	28.8	121.2	132.2	-63.3	169.5	-21.4	0	0	119.9
755	A	29.5	Very low	28.6	Very low	89 Å²	89	151.3 Å²	151.3	74%	0.736	77%	0.769	S	S	*	*				-175.1	115	101.6	0	0	0	0	0	115
756	N	28.8	Very low	28.4	Very low	127 Å²	127	152 Å²	152	68%	0.679	77%	0.774	S	S	*	*			trans	71.6	131.2	135.7	-61.7	-5.3	0	0	0	125.2
757	Y	30.3	Very low	28.5	Very low	204 Å²	204	151.2 Å²	151.2	80%	0.8	77%	0.774	S	S	*	*			trans	69.2	136.4	159.6	-51	-61.5	0	0	0	118.5
758	T	29.8	Very low	28.5	Very low	106 Å²	106	147.2 Å²	147.2	65%	0.65	77%	0.766	S	S	*	*			cis	-170.5	141.1	-13.9	16.7	0	0	0	0	108.5
759	N	26.9	Very low	28.4	Very low	147 Å²	147	147.8 Å²	147.8	79%	0.786	77%	0.765	S	S	*	*			trans	55.2	146.7	157.1	-53.3	-3.9	0	0	0	117.5
760	T	32.2	Very low	28.6	Very low	108 Å²	108	148.9 Å²	148.9	66%	0.663	77%	0.767	S	S	*	*			cis	-154.7	160	16.6	-20.6	0	0	0	0	108.6
761	E	28.8	Very low	28.3	Very low	159 Å²	159	152 Å²	152	74%	0.743	77%	0.771	S	S	*	*			trans	31.4	143.8	146.3	-69	156	-164.1	0	0	121.8
762	M	30.8	Very low	28.3	Very low	147 Å²	147	155.1 Å²	155.1	72%	0.724	78%	0.777	S	S	*	*			cis	-159.2	163.8	8.2	-129.9	-179.2	-73.4	0	0	111.1
763	N	30.4	Very low	28.2	Very low	143 Å²	143	158.5 Å²	158.5	77%	0.765	78%	0.784	S	S	*	*			trans	62.7	89.9	158.2	-62.9	-8	0	0	0	121.7
764	K	26.5	Very low	28	Very low	196 Å²	196	158.2 Å²	158.2	85%	0.852	79%	0.787	S	S	*	*			trans	-40.2	162.8	132.2	-61.6	167.4	-179.3	173.2	0	111.1
765	R	29.4	Very low	27.8	Very low	233 Å²	233	156.1 Å²	156.1	88%	0.879	79%	0.787	S	S	*	*				-166.8	120.3	51.4	-151.7	172	-164.9	165.3	-0.1	112.2
766	S	24.7	Very low	27.7	Very low	115 Å²	115	160.4 Å²	160.4	80%	0.804	79%	0.791	S	S	*	*			trans	-78.5	144.3	157.8	45.9	0	0	0	0	109.8
767	V	28	Very low	27.7	Very low	120 Å²	120	160.7 Å²	160.7	73%	0.727	80%	0.797	S	S	*	*			trans	-89.8	115.8	174	178	0	0	0	0	109.1	Y769	V767-Y769 HydrophobicContact CG1-CE2 4.48Å
768	H	27	Very low	27.4	Very low	173 Å²	173	159.1 Å²	159.1	80%	0.801	80%	0.802	S	S	*	*			trans	-91.8	133.8	158.8	-99	-20.9	0	0	0	108.2
769	Y	26.2	Very low	27.3	Very low	189 Å²	189	161.8 Å²	161.8	74%	0.741	81%	0.812	S	S	*	*			trans	-82.5	125.9	158.4	-78.7	-88	0	0	0	108.3	V767	V767-Y769 HydrophobicContact CG1-CE2 4.48Å
770	N	28.6	Very low	27.4	Very low	145 Å²	145	164.6 Å²	164.6	78%	0.775	82%	0.817	S	S	*	*			trans	-113.7	118.8	165	-78.1	5.6	0	0	0	107.5
771	E	23.6	Very low	27.2	Very low	193 Å²	193	167.5 Å²	167.5	90%	0.902	83%	0.829	S	S	*	*			trans	-74.9	120.2	155.2	-65.4	177.5	129.7	0	0	107.7
772	E	24.8	Very low	27.4	Very low	182 Å²	182	164.9 Å²	164.9	85%	0.85	83%	0.834	S	S	*	*			trans	159.8	78.1	156	-94.4	-179	-168.1	0	0	110.1
773	Q	27.6	Very low	27.3	Very low	196 Å²	196	165.3 Å²	165.3	92%	0.916	84%	0.838	S	S	*	*			trans	179	90.7	152.7	-105.8	162.6	63.2	0	0	111.1
774	L	26.8	Very low	27.2	Very low	167 Å²	167	163.4 Å²	163.4	87%	0.874	84%	0.836	S	S	*	*			trans	-165.5	70.2	156.8	-111.5	163.6	0	0	0	111.6
775	V	23.9	Very low	27.3	Very low	140 Å²	140	159.6 Å²	159.6	85%	0.848	83%	0.829	S	S	*	*			trans	-130.7	84.8	159.2	-179.3	0	0	0	0	108.2
776	Q	26.9	Very low	27.2	Very low	179 Å²	179	156.3 Å²	156.3	84%	0.836	82%	0.824	S	S	*	*			trans	-167	148	159.7	-112.8	162.6	66.3	0	0	109.6
777	V	28.4	Very low	27.5	Very low	133 Å²	133	158.1 Å²	158.1	81%	0.806	82%	0.824	S	S	*	*	S	Bend	trans	71	79.7	-179.3	-162.4	0	0	0	0	115.3
778	L	24.7	Very low	27.6	Very low	171 Å²	171	160.8 Å²	160.8	90%	0.895	83%	0.829	S	S	*	*				-169.1	89.2	118.1	-100.1	165.4	0	0	0	109.1
779	N	26.9	Very low	27.7	Very low	162 Å²	162	158.5 Å²	158.5	87%	0.866	83%	0.827	S	S	*	*			trans	-154.5	96.9	168.8	-126.6	-5.4	0	0	0	107.3
780	K	30.1	Very low	27.9	Very low	205 Å²	205	155.1 Å²	155.1	89%	0.891	82%	0.822	S	S	*	*			trans	-161.1	65.1	177.2	-121.2	-168.5	-171.4	-171.6	0	112
781	D	28	Very low	28	Very low	170 Å²	170	154.6 Å²	154.6	91%	0.909	81%	0.813	S	S	*	*			trans	-89.6	130	153.2	-73	-39.2	0	0	0	108.9
782	A	32.4	Very low	28.5	Very low	103 Å²	103	153.8 Å²	153.8	85%	0.851	80%	0.802	S	S	*	*			trans	-132.4	136.9	168.9	0	0	0	0	0	108.3
783	I	28.5	Very low	28.7	Very low	157 Å²	157	152.1 Å²	152.1	81%	0.805	79%	0.794	S	S	*	*			trans	-89.9	160.9	-163.7	-69.5	160.2	0	0	0	111.4
784	S	27.7	Very low	28.9	Very low	103 Å²	103	149.7 Å²	149.7	72%	0.72	79%	0.788	S	S	*	*			trans	69.7	142.4	163.6	53.2	0	0	0	0	117.5
785	T	29.9	Very low	29.2	Very low	116 Å²	116	145.6 Å²	145.6	71%	0.712	78%	0.778	S	S	*	*			cis	-160	152.3	2.5	8.1	0	0	0	0	110.8
786	E	26	Very low	29.6	Very low	164 Å²	164	145.7 Å²	145.7	77%	0.766	77%	0.774	S	S	*	*			trans	13	122.3	141.6	-61.5	163.9	164	0	0	118.8
787	D	31.4	Very low	29.8	Very low	152 Å²	152	144.6 Å²	144.6	81%	0.813	77%	0.769	S	S	*	*				169.6	161.3	89.8	-104.7	-28.9	0	0	0	115.9
788	E	31	Very low	30	Very low	176 Å²	176	143.5 Å²	143.5	82%	0.822	76%	0.758	S	S	*	*			trans	53	105.5	165.4	-63.2	-171.2	158.3	0	0	120.3
789	V	28.2	Very low	30.3	Very low	126 Å²	126	142.4 Å²	142.4	76%	0.764	75%	0.749	S	S	*	*				72.4	132.8	65.1	179.2	0	0	0	0	115.5
790	D	31.2	Very low	30.5	Very low	118 Å²	118	142.3 Å²	142.3	63%	0.631	74%	0.743	S	S	*	*			trans	72.3	144	167.8	-78.5	0.7	0	0	0	118.3
791	K	30.6	Very low	30.5	Very low	134 Å²	134	140.4 Å²	140.4	58%	0.583	74%	0.737	S	S	*	*			cis	-172.3	158.1	-18.6	-124.9	169.4	-171.8	118.5	0	110.9
792	Y	32.9	Very low	30.7	Very low	176 Å²	176	137 Å²	137	69%	0.69	73%	0.727	S	S	*	*			trans	68.4	121.5	151.1	-69	-50.9	0	0	0	123.4
793	E	29.7	Very low	30.6	Very low	146 Å²	146	137 Å²	137	68%	0.682	73%	0.726	S	S	*	*				73.5	113.4	122.8	-72.1	162.3	-170.3	0	0	122
794	D	31.5	Very low	30.7	Very low	145 Å²	145	133.9 Å²	133.9	78%	0.775	73%	0.725	S	S	*	*				94.1	127.3	116.6	-68.8	1.8	0	0	0	122.9
795	A	33.7	Very low	30.8	Very low	81 Å²	81	132.1 Å²	132.1	67%	0.669	72%	0.716	S	S	*	*			trans	96.3	115.4	131	0	0	0	0	0	120.3
796	D	31.9	Very low	30.7	Very low	143 Å²	143	135 Å²	135	77%	0.765	72%	0.721	S	S	*	*			trans	81.6	88.5	130.9	-56.1	-3.4	0	0	0	120.1
797	E	32	Very low	30.8	Very low	156 Å²	156	135 Å²	135	73%	0.729	72%	0.722	S	S	*	*				55	133	99.2	-79.1	-167.6	-164.5	0	0	121.5
798	N	31.3	Very low	30.6	Very low	110 Å²	110	135.8 Å²	135.8	59%	0.588	72%	0.721	S	S	*	*			trans	80.8	141.1	134.5	-64	2.1	0	0	0	119.7
799	E	31.2	Very low	30.4	Very low	147 Å²	147	135.6 Å²	135.6	69%	0.687	72%	0.72	S	S	*	*			cis	-171	-177.8	-18.4	-135	167.1	178.3	0	0	109.9
800	E	31.7	Very low	30.6	Very low	161 Å²	161	138.3 Å²	138.3	75%	0.752	73%	0.726	S	S	*	*			trans	65.6	156	152.4	-73	175.5	-179.9	0	0	120.5
801	E	30.1	Very low	30.6	Very low	164 Å²	164	140.7 Å²	140.7	77%	0.766	73%	0.734	S	S	*	*			cis	-169.3	167.8	-34	-157	176.1	-158.7	0	0	109
802	S	30.8	Very low	30.6	Very low	100 Å²	100	141.5 Å²	141.5	70%	0.699	74%	0.744	S	S	*	*			trans	119.6	113.1	132.5	75.2	0	0	0	0	119.8
803	A	31.3	Very low	30.8	Very low	101 Å²	101	139.6 Å²	139.6	84%	0.835	75%	0.746	S	S	*	*				67.9	151.9	124.2	0	0	0	0	0	121.9
804	A	29.9	Very low	31	Very low	93 Å²	93	141.4 Å²	141.4	77%	0.769	75%	0.754	S	S	*	*			cis	-174.3	168.8	-21.8	0	0	0	0	0	109.9
805	A	30.6	Very low	30.9	Very low	66 Å²	66	141.4 Å²	141.4	55%	0.545	75%	0.754	S	S	.	*			trans	68.7	112.6	153.7	0	0	0	0	0	120
806	E	28	Very low	30.7	Very low	175 Å²	175	146 Å²	146	82%	0.818	77%	0.767	S	S	*	*				87.1	152.9	96.6	-76.7	114.7	-122.4	0	0	112.5
807	E	28	Very low	30.7	Very low	165 Å²	165	145.7 Å²	145.7	77%	0.771	76%	0.763	S	S	*	*			cis	-156.1	147.4	14.2	-131.9	159.1	-153.7	0	0	112
808	E	27.3	Very low	30.3	Very low	169 Å²	169	145.5 Å²	145.5	79%	0.79	76%	0.762	S	S	*	*			trans	52.9	136.9	151.3	-72.9	177.4	179	0	0	129.4
809	E	26.9	Very low	30	Very low	172 Å²	172	149.4 Å²	149.4	80%	0.804	78%	0.777	S	S	*	*			trans	62.1	121.1	143.4	-66.7	-174.4	174.5	0	0	126.5
810	M	32.3	Very low	29.7	Very low	183 Å²	183	148.7 Å²	148.7	90%	0.901	78%	0.783	S	S	*	*				-166.6	158	117.8	-92.3	-112.8	-63.2	0	0	112
811	E	30.2	Very low	29.4	Very low	168 Å²	168	146.1 Å²	146.1	79%	0.785	78%	0.783	S	S	*	*			trans	-93	169	-161.5	-60.2	158	129.4	0	0	115.3
812	D	32.2	Very low	29.1	Very low	150 Å²	150	145.9 Å²	145.9	80%	0.802	79%	0.792	S	S	*	*				-179.5	102.1	129.8	-92.7	-8.1	0	0	0	109.8
813	D	35.7	Very low	28.8	Very low	137 Å²	137	143.7 Å²	143.7	73%	0.733	79%	0.785	S	S	*	*			trans	41.2	149	136.2	-56.4	-15.6	0	0	0	122.4
814	E	35.2	Very low	28.4	Very low	184 Å²	184	147.7 Å²	147.7	86%	0.86	78%	0.784	S	S	*	*			cis	-154	161.1	13.3	-142.1	172.6	-159.6	0	0	110.9
815	D	28.7	Very low	28.1	Very low	145 Å²	145	153.6 Å²	153.6	78%	0.775	79%	0.788	S	S	*	*			trans	-75.8	155.5	-175.3	-68.9	-64.6	0	0	0	115.8
816	D	30	Very low	28	Very low	176 Å²	176	158.4 Å²	158.4	94%	0.941	80%	0.803	S	S	*	*			trans	-150.9	126.6	138.3	-126.7	-18	0	0	0	110.9
817	M	30.5	Very low	27.8	Very low	138 Å²	138	157.5 Å²	157.5	68%	0.68	80%	0.803	S	S	*	*			trans	-93	149.6	-162.9	-84.9	-104.7	-69.8	0	0	115
818	E	24.9	Very low	27.6	Very low	152 Å²	152	156 Å²	156	71%	0.71	80%	0.801	S	S	*	*			trans	43.6	98.8	146	-63.1	-176.3	158.1	0	0	119.5
819	Q	24.3	Very low	27.5	Very low	192 Å²	192	155.5 Å²	155.5	90%	0.897	80%	0.803	S	S	*	*				175.4	87.3	119.7	-95.4	169.3	45.6	0	0	111
820	T	24.4	Very low	27.5	Very low	132 Å²	132	153.8 Å²	153.8	81%	0.81	80%	0.799	S	S	*	*			trans	-132.4	122.6	167.1	54.5	0	0	0	0	111.2	V822	T820-V822 PolarHBondContact O-N 2.81Å
821	S	26.4	Very low	27.2	Very low	107 Å²	107	149.8 Å²	149.8	75%	0.748	79%	0.789	S	S	*	*			trans	-58.4	117.4	178.3	44.4	0	0	0	0	112.3	G823	S821-G823 PolarHBondContact O-N 3.11Å
822	V	23.5	Very low	27	Very low	158 Å²	158	148.5 Å²	148.5	96%	0.958	79%	0.788	S	S	*	*	S	Bend	trans	-73.4	77.2	169.8	-174.5	0	0	0	0	108.5	T820	T820-V822 PolarHBondContact O-N 2.81Å
823	G	23.7	Very low	26.9	Very low	54 Å²	54	147.8 Å²	147.8	56%	0.557	78%	0.784	S	S	*	*			trans	-178.1	54	-171.8	0	0	0	0	0	114.2	S821	S821-G823 PolarHBondContact O-N 3.11Å
824	K	23.5	Very low	26.5	Very low	185 Å²	185	147.6 Å²	147.6	80%	0.804	78%	0.782	S	S	*	*	S	Bend	trans	-167.4	5.8	164.9	-111.5	146.3	-168.7	172	0	118.9
825	Y	23.9	Very low	26.2	Very low	218 Å²	218	142.3 Å²	142.3	86%	0.855	77%	0.77	S	S	*	*	S	Bend	trans	-125.8	36.6	-173.8	-72.5	-72.4	0	0	0	115.6
826	L	27.7	Very low	26.1	Very low	166 Å²	166	140.5 Å²	140.5	87%	0.869	76%	0.76	S	S	*	*	S	Bend	trans	-131.2	12.7	176.1	-82.4	174.2	0	0	0	115.4
827	L	24.4	Very low	26.1	Very low	156 Å²	156	135 Å²	135	82%	0.817	74%	0.739	S	S	*	*	S	Bend	trans	-111.8	4.7	-173.3	-73.3	174.5	0	0	0	116.5
828	N	24.1	Very low	25.9	Very low	135 Å²	135	132.1 Å²	132.1	72%	0.722	74%	0.737	S	S	*	*	S	Bend	trans	-104.5	21.6	-174.1	-76.6	17.6	0	0	0	115.5
829	N	26.2	Very low	26	Very low	158 Å²	158	126.3 Å²	126.3	85%	0.845	71%	0.713	S	S	*	*	S	Bend	trans	-137.1	19.4	-178.5	-92.1	-28.8	0	0	0	115.2
830	L	25.6	Very low	26.2	Very low	136 Å²	136	123 Å²	123	71%	0.712	70%	0.698	S	S	*	*	S	Bend	trans	-121.2	-0.8	-178.3	-86.5	163.4	0	0	0	115.7
831	S	26	Very low	26.5	Very low	99 Å²	99	119.8 Å²	119.8	69%	0.692	68%	0.684	S	S	*	*	S	Bend	trans	-66.4	-43.1	-179.8	171.6	0	0	0	0	113.6
832	D	26.6	Very low	26.5	Very low	141 Å²	141	116.2 Å²	116.2	75%	0.754	66%	0.659	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.3	2.5	-157.8	-59.2	-17.5	0	0	0	115.1
833	N	29.2	Very low	26.7	Very low	135 Å²	135	114.2 Å²	114.2	72%	0.722	65%	0.648	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.3	-1	178.1	-76.5	-58.3	0	0	0	114.2
834	L	28.4	Very low	27	Very low	133 Å²	133	115.4 Å²	115.4	70%	0.696	64%	0.644	S	S	*	*	H	α-helix	trans	-88.9	-26.8	-174.8	-155.1	68.3	0	0	0	113.4
835	A	28.7	Very low	27.2	Very low	72 Å²	72	110.9 Å²	110.9	60%	0.595	63%	0.628	S	S	*	*	H	α-helix	trans	-70.7	-39.3	-179.3	0	0	0	0	0	113.4
836	D	26.4	Very low	27.5	Very low	107 Å²	107	104.9 Å²	104.9	57%	0.572	61%	0.614	S	S	*	*	H	α-helix	trans	-79.3	-21.9	178.2	-86.5	-19.3	0	0	0	113	A838 S839	D836-A838 VanDerWaalsContact C-N 3.35Å; D836-A838 PolarHBondContact O-N 3Å; D836-S839 PolarHBondContact O-N 3.24Å; D836-S839 PolarHBondContact O-OG 3.03Å
837	A	30	Very low	27.5	Very low	60 Å²	60	99.2 Å²	99.2	50%	0.496	60%	0.596	S	S	.	*	H	α-helix	trans	-66.1	-34.7	173.8	0	0	0	0	0	112.8	S839	A837-S839 VanDerWaalsContact C-N 3.32Å; A837-S839 PolarHBondContact O-N 3.07Å
838	A	27	Very low	27.8	Very low	78 Å²	78	98 Å²	98	65%	0.645	59%	0.59	S	S	*	*	H	α-helix	trans	-68.2	-29.1	177.7	0	0	0	0	0	113	D836 H840	D836-A838 VanDerWaalsContact C-N 3.35Å; D836-A838 PolarHBondContact O-N 3Å; A838-H840 PolarHBondContact O-N 3.02Å
839	S	27.1	Very low	28.2	Very low	30 Å²	30	94.6 Å²	94.6	21%	0.21	57%	0.571	C	S	.	*	H	α-helix	trans	-78.5	-15.9	-176.1	79.7	0	0	0	0	114.6	D836 A837	D836-S839 PolarHBondContact O-N 3.24Å; D836-S839 PolarHBondContact O-OG 3.03Å; A837-S839 VanDerWaalsContact C-N 3.32Å; A837-S839 PolarHBondContact O-N 3.07Å
840	H	28.1	Very low	28.4	Very low	124 Å²	124	90.2 Å²	90.2	57%	0.574	55%	0.548	S	S	*	.	H	α-helix	trans	-104.2	-7.6	179.8	-78.2	-77.7	0	0	0	114.3	A838 S842	A838-H840 PolarHBondContact O-N 3.02Å; H840-S842 PolarHBondContact O-N 3.38Å; H840-S842 VanDerWaalsContact O-N 3.14Å
841	A	29.2	Very low	28.4	Very low	64 Å²	64	92 Å²	92	53%	0.529	55%	0.55	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-19.8	-177.3	0	0	0	0	0	114.5
842	S	27.7	Very low	28.5	Very low	32 Å²	32	91.8 Å²	91.8	22%	0.224	55%	0.547	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.8	-15	-170.6	-170.3	0	0	0	0	115.9	H840 S1012 K1391	H840-S842 PolarHBondContact O-N 3.38Å; H840-S842 VanDerWaalsContact O-N 3.14Å; S842-S1012 WeakPolarHBondContact OG-CB 3.23Å; S842-K1391 WeakPolarHBondContact OG-CE 3.49Å; S842-K1391 PolarHBondContact OG-NZ 3.26Å
843	T	27.2	Very low	28.5	Very low	116 Å²	116	93.6 Å²	93.6	71%	0.712	55%	0.548	S	S	*	.	S	Bend	trans	-114.1	-2.8	-175.9	52.6	0	0	0	0	114.1
844	T	29.2	Very low	28.3	Very low	79 Å²	79	93.9 Å²	93.9	49%	0.485	55%	0.554	S	S	.	*			trans	-109.5	12	-179.2	50.7	0	0	0	0	114.8	T846 G847	T844-T846 PolarHBondContact O-N 2.83Å; T844-G847 PolarHBondContact O-N 2.99Å
845	L	28.9	Very low	28.2	Very low	89 Å²	89	93.9 Å²	93.9	47%	0.466	55%	0.554	S	S	.	*	H	α-helix	trans	-56.9	-23.1	178.9	-107.7	164.6	0	0	0	113.8
846	T	29.5	Very low	28.2	Very low	92 Å²	92	96.7 Å²	96.7	56%	0.564	56%	0.563	S	S	*	*	H	α-helix	trans	-76.4	-19.2	178.4	-25.2	0	0	0	0	114	T844	T844-T846 PolarHBondContact O-N 2.83Å
847	G	28.5	Very low	28.2	Very low	48 Å²	48	99.2 Å²	99.2	50%	0.495	57%	0.565	S	S	.	*	H	α-helix	trans	-100.5	-27.1	-174.5	0	0	0	0	0	115.2	T844 L849 N850	T844-G847 PolarHBondContact O-N 2.99Å; G847-L849 VanDerWaalsContact C-N 3.33Å; G847-L849 PolarHBondContact O-N 2.8Å; G847-N850 PolarHBondContact O-N 2.84Å
848	L	31.2	Very low	28	Very low	129 Å²	129	105.2 Å²	105.2	68%	0.675	58%	0.579	S	S	*	*	H	α-helix	trans	-74.8	-20.5	-178.9	-102.9	148.1	0	0	0	113.9	N850	L848-N850 VanDerWaalsContact C-N 3.26Å; L848-N850 PolarHBondContact O-N 3.4Å
849	L	30.9	Very low	28	Very low	64 Å²	64	104.5 Å²	104.5	34%	0.335	57%	0.57	S	S	.	*	T	Hydrogen-bonded Turn	trans	-75.6	-5.3	172.3	-81.3	155.2	0	0	0	114.5	G847	G847-L849 VanDerWaalsContact C-N 3.33Å; G847-L849 PolarHBondContact O-N 2.8Å
850	N	31.5	Very low	27.9	Very low	67 Å²	67	106.6 Å²	106.6	36%	0.358	60%	0.596	S	S	.	*	T	Hydrogen-bonded Turn	trans	-103.5	17.7	-176.6	-65.4	-13.4	0	0	0	113.9	G847 L848	G847-N850 PolarHBondContact O-N 2.84Å; L848-N850 VanDerWaalsContact C-N 3.26Å; L848-N850 PolarHBondContact O-N 3.4Å
851	K	26	Very low	27.8	Very low	172 Å²	172	104.9 Å²	104.9	75%	0.748	60%	0.598	S	S	*	*	S	Bend	trans	-126.9	114.8	170.7	-71.6	-171.4	177.9	-176.7	0	110.2	K853	K851-K853 PolarHBondContact O-N 3.07Å
852	P	27.8	Very low	27.8	Very low	96 Å²	96	108.2 Å²	108.2	62%	0.623	61%	0.606	S	S	*	*			trans	-69.9	97.7	170.9	29.4	-32	0	0	0	108.4	T854	P852-T854 PolarHBondContact O-N 2.78Å
853	K	25.6	Very low	27.9	Very low	178 Å²	178	112 Å²	112	77%	0.774	62%	0.622	S	S	*	*			trans	-70.5	98.1	162.7	-79.2	-174.5	178.1	178.8	0	107.4	K851 I855	K851-K853 PolarHBondContact O-N 3.07Å; K853-I855 PolarHBondContact O-N 3.41Å
854	T	26.1	Very low	28	Very low	141 Å²	141	113.1 Å²	113.1	87%	0.865	62%	0.617	S	S	*	*			trans	-72.8	64.5	174.9	12.4	0	0	0	0	111.6	P852	P852-T854 PolarHBondContact O-N 2.78Å
855	I	26.3	Very low	27.9	Very low	134 Å²	134	117.6 Å²	117.6	69%	0.687	63%	0.63	S	S	*	*			trans	-132.5	143.2	166.8	-56.1	-178.8	0	0	0	105.8	K853	K853-I855 PolarHBondContact O-N 3.41Å
856	V	27	Very low	27.8	Very low	130 Å²	130	121.1 Å²	121.1	79%	0.788	65%	0.646	S	S	*	*	S	Bend	trans	68.2	61.3	-163.1	-161.1	0	0	0	0	113.8
857	R	27.6	Very low	27.7	Very low	160 Å²	160	120.6 Å²	120.6	60%	0.604	65%	0.65	S	S	*	*			trans	-168.5	72.4	149.2	-106.7	170	-155.1	168.7	7.2	110.8	D994 N996	R857-D994 IonicContact CZ-OD1 3.57Å; R857-D994 IonicContact CZ-OD2 3.68Å; R857-D994 IonicContact NH1-OD1 3.73Å; R857-D994 PolarHBondContact NH1-OD1 2.97Å; R857-D994 VanDerWaalsContact NH1-OD1 3.11Å; R857-D994 IonicContact NH1-OD2 3.22Å; R857-D994 PolarHBondContact NH1-OD2 3.3Å; R857-D994 IonicContact NH2-OD1 2.85Å; R857-D994 PolarHBondContact NH2-OD1 3.47Å; R857-D994 IonicContact NH2-OD2 2.86Å; R857-N996 PolarHBondContact NH1-ND2 3.41Å
858	K	25.3	Very low	27.6	Very low	186 Å²	186	123.9 Å²	123.9	81%	0.809	66%	0.661	S	S	*	*			trans	-128.4	6.9	170	-104.2	-172.1	179.5	-178.8	0	115.4
859	S	26.6	Very low	27.3	Very low	63 Å²	63	125.9 Å²	125.9	44%	0.441	67%	0.667	S	S	.	*	S	Bend	trans	-101.8	118.8	159	39	0	0	0	0	109.7	E455 I1054	E455-S859 WeakPolarHBondContact OE2-CB 3.32Å; E455-S859 PolarHBondContact OE2-OG 3.09Å; S859-I1054 WeakPolarHBondContact OG-CD1 3.23Å
860	G	26.1	Very low	27	Very low	74 Å²	74	131.2 Å²	131.2	76%	0.763	69%	0.694	S	S	*	*	S	Bend	trans	140.3	-25	-179.4	0	0	0	0	0	116.2
861	S	26.2	Very low	26.8	Very low	89 Å²	89	132.8 Å²	132.8	62%	0.622	72%	0.716	S	S	*	*	S	Bend	trans	-96.8	-18.6	-177.2	-171.2	0	0	0	0	114.7
862	L	28.3	Very low	26.7	Very low	133 Å²	133	130.4 Å²	130.4	70%	0.696	72%	0.721	S	S	*	*	G	3₁₀ helix	trans	-81.8	-27.4	-172	-140	141.7	0	0	0	113.2	K864	L862-K864 VanDerWaalsContact C-N 3.3Å; L862-K864 PolarHBondContact O-N 3.09Å
863	M	30	Very low	26.9	Very low	111 Å²	111	132.3 Å²	132.3	55%	0.547	73%	0.732	S	S	.	*	G	3₁₀ helix	trans	-75.9	-13.2	179.9	-145.8	-175.8	-65.6	0	0	113.8	S478 Q480	S478-M863 WeakPolarHBondContact O-CE 3.29Å; Q480-M863 HydrophobicContact CG-CE 3.93Å; Q480-M863 HydrophobicContact CG-SD 4.24Å
864	K	28.5	Very low	27.3	Very low	140 Å²	140	129.8 Å²	129.8	61%	0.609	73%	0.731	S	S	*	*	G	3₁₀ helix	trans	-94	-11	179.1	-143.5	-172.5	-178.8	-157.5	0	113.8	L862 D949	L862-K864 VanDerWaalsContact C-N 3.3Å; L862-K864 PolarHBondContact O-N 3.09Å; K864-D949 IonicContact NZ-OD1 3.39Å; K864-D949 PolarHBondContact NZ-OD1 3.09Å
865	K	28.3	Very low	27.4	Very low	174 Å²	174	132 Å²	132	76%	0.757	73%	0.729	S	S	*	*	S	Bend	trans	-98.7	-6.2	-179.6	-86.5	-173.5	171.8	-176.7	0	115.3
866	M	27.6	Very low	27.7	Very low	163 Å²	163	131.2 Å²	131.2	80%	0.803	73%	0.73	S	S	*	*	S	Bend	trans	-104.8	7	172.8	-73.5	-179.5	168.2	0	0	113.4
867	A	25.5	Very low	27.9	Very low	80 Å²	80	130.3 Å²	130.3	66%	0.661	73%	0.725	S	S	*	*	S	Bend	trans	-105.3	14.8	178	0	0	0	0	0	113.2
868	T	26.3	Very low	28	Very low	118 Å²	118	129.4 Å²	129.4	72%	0.724	73%	0.732	S	S	*	*	S	Bend	trans	-138.4	22.4	-174.6	23.8	0	0	0	0	114.2
869	E	25.2	Very low	28.1	Very low	171 Å²	171	126.1 Å²	126.1	80%	0.799	73%	0.728	S	S	*	*	S	Bend	trans	-122.7	149.6	151.4	-70.3	-171.6	146.6	0	0	107.3
870	I	25.9	Very low	28.2	Very low	175 Å²	175	129.8 Å²	129.8	90%	0.897	75%	0.748	S	S	*	*	S	Bend	trans	71.5	70.3	-165.5	-41.3	167.5	0	0	0	114
871	A	26.5	Very low	28.3	Very low	100 Å²	100	130 Å²	130	83%	0.826	75%	0.75	S	S	*	*			trans	-175.7	66.2	146	0	0	0	0	0	112.7
872	S	25.1	Very low	28.3	Very low	122 Å²	122	133.3 Å²	133.3	85%	0.853	76%	0.761	S	S	*	*			trans	-114.5	50.6	172.6	66.9	0	0	0	0	112.9
873	T	31.2	Very low	28.4	Very low	137 Å²	137	136.2 Å²	136.2	84%	0.84	77%	0.768	S	S	*	*			trans	-140.8	117.8	165.9	35.2	0	0	0	0	112
874	T	33.6	Very low	28.3	Very low	124 Å²	124	135.3 Å²	135.3	76%	0.761	77%	0.773	S	S	*	*			trans	-45.3	141.3	175.2	44.8	0	0	0	0	118.1
875	K	28.3	Very low	28.2	Very low	189 Å²	189	132.8 Å²	132.8	82%	0.822	77%	0.773	S	S	*	*				42	136.9	123.6	-64.4	178.1	178.4	179.1	0	118.5
876	T	32.5	Very low	28.2	Very low	117 Å²	117	134 Å²	134	72%	0.718	77%	0.774	S	S	*	*			cis	-173.7	150.4	25.7	12.6	0	0	0	0	112.2
877	T	30.9	Very low	28.3	Very low	111 Å²	111	132.2 Å²	132.2	68%	0.681	77%	0.766	S	S	*	*			trans	47.5	125.2	146.6	58.7	0	0	0	0	124
878	D	29.4	Very low	28.5	Very low	140 Å²	140	135 Å²	135	75%	0.749	77%	0.77	S	S	*	*			trans	73.4	103.9	131.2	-54.3	-7.8	0	0	0	124
879	T	28.6	Very low	28.6	Very low	117 Å²	117	138.8 Å²	138.8	72%	0.718	78%	0.776	S	S	*	*				67.8	117.3	118.7	-47.9	0	0	0	0	122.5
880	T	27.4	Very low	29.3	Very low	140 Å²	140	135 Å²	135	86%	0.859	77%	0.767	S	S	*	*			trans	69.3	130.5	156.8	53.8	0	0	0	0	121.8
881	G	28.7	Very low	29.3	Very low	79 Å²	79	133.4 Å²	133.4	81%	0.814	76%	0.759	S	S	*	*			trans	148.4	81.7	151.8	0	0	0	0	0	119.9
882	N	26.6	Very low	29.3	Very low	159 Å²	159	134.9 Å²	134.9	85%	0.85	75%	0.753	S	S	*	*			trans	-8.6	127.4	154.8	-79.6	-24.5	0	0	0	120.1
883	K	30	Very low	29.5	Very low	193 Å²	193	134.7 Å²	134.7	84%	0.839	75%	0.747	S	S	*	*				171	124.2	108.5	-98.7	174.1	-176.6	177.2	0	116.4
884	S	28.3	Very low	29.5	Very low	93 Å²	93	134.2 Å²	134.2	65%	0.65	74%	0.739	S	S	*	*			trans	38	120.1	134.4	69.3	0	0	0	0	122.8
885	S	26.7	Very low	29.3	Very low	86 Å²	86	134 Å²	134	60%	0.601	73%	0.733	S	S	*	*				65.8	137.5	119.5	77.6	0	0	0	0	119.7
886	Y	29.1	Very low	29.4	Very low	201 Å²	201	132 Å²	132	79%	0.788	73%	0.732	S	S	*	*			cis	-176.3	155.5	46.4	-102.2	-54.3	0	0	0	112.1
887	I	30	Very low	29.2	Very low	125 Å²	125	134 Å²	134	64%	0.641	73%	0.731	S	S	*	*			trans	79.2	118.4	133.7	-73.5	167.4	0	0	0	122.7
888	N	29.6	Very low	29.3	Very low	138 Å²	138	134.8 Å²	134.8	74%	0.738	74%	0.737	S	S	*	*			trans	65.3	124.8	142.5	-59.8	4.5	0	0	0	119.8
889	K	26.9	Very low	29.2	Very low	197 Å²	197	134 Å²	134	86%	0.857	73%	0.733	S	S	*	*			cis	64.7	162.7	29.1	-113.9	-163.5	179.5	-174.4	0	112.3
890	P	40.3	Very low	29.1	Very low	93 Å²	93	131.9 Å²	131.9	60%	0.604	73%	0.734	S	S	*	*			cis	-148.1	-164.5	-13.9	29.3	-2.3	0	0	0	116
891	L	27.1	Very low	28.9	Very low	140 Å²	140	132.8 Å²	132.8	73%	0.733	73%	0.734	S	S	*	*			trans	71.4	150.5	154.1	-82	111.1	0	0	0	120
892	D	26	Very low	28.9	Very low	132 Å²	132	136.6 Å²	136.6	71%	0.706	74%	0.735	S	S	*	*			cis	-179.7	-178.5	-29.3	-99.1	-6.2	0	0	0	109
893	V	29.8	Very low	28.8	Very low	117 Å²	117	135.7 Å²	135.7	71%	0.709	73%	0.729	S	S	*	*			trans	102.9	111.4	145.4	-170.6	0	0	0	0	120.6
894	N	29.8	Very low	28.6	Very low	128 Å²	128	134.6 Å²	134.6	68%	0.684	73%	0.726	S	S	*	*			trans	99.2	113.8	139.3	-79.6	-0.1	0	0	0	125.8
895	N	29.7	Very low	28.4	Very low	118 Å²	118	135.2 Å²	135.2	63%	0.631	73%	0.73	S	S	*	*				94.2	117	114.9	-71	-0.4	0	0	0	124.6
896	N	30.6	Very low	28.2	Very low	149 Å²	149	136.3 Å²	136.3	80%	0.797	74%	0.744	S	S	*	*				99.3	130	126.4	-68.3	-3.3	0	0	0	122.6
897	K	28.3	Very low	27.9	Very low	159 Å²	159	132.1 Å²	132.1	69%	0.691	74%	0.744	S	S	*	*			trans	-47.1	161.9	171.2	-120.7	-170.6	-176.5	-153.4	0	115.6	D899	K897-D899 VanDerWaalsContact CE-OD1 3.25Å; K897-D899 WeakPolarHBondContact CE-OD1 3.49Å; K897-D899 IonicContact NZ-OD1 2.63Å; K897-D899 PolarHBondContact NZ-OD1 3.42Å; K897-D899 IonicContact NZ-OD2 3.01Å; K897-D899 PolarHBondContact NZ-OD2 2.96Å
898	P	33.6	Very low	27.6	Very low	126 Å²	126	135.3 Å²	135.3	82%	0.818	75%	0.754	S	S	*	*				-144.1	175.8	87.1	38.9	-22.3	0	0	0	116.8
899	D	25.8	Very low	27.2	Very low	125 Å²	125	139.3 Å²	139.3	67%	0.668	77%	0.765	S	S	*	*			trans	-87	165.5	-176.2	-55.8	-73.2	0	0	0	114.3	K897	K897-D899 VanDerWaalsContact CE-OD1 3.25Å; K897-D899 WeakPolarHBondContact CE-OD1 3.49Å; K897-D899 IonicContact NZ-OD1 2.63Å; K897-D899 PolarHBondContact NZ-OD1 3.42Å; K897-D899 IonicContact NZ-OD2 3.01Å; K897-D899 PolarHBondContact NZ-OD2 2.96Å
900	G	27.7	Very low	27	Very low	72 Å²	72	135.9 Å²	135.9	74%	0.742	76%	0.76	S	S	*	*			trans	146.2	82.2	160.6	0	0	0	0	0	118.7
901	D	23	Very low	26.2	Very low	159 Å²	159	138.4 Å²	138.4	85%	0.85	77%	0.768	S	S	*	*			trans	31.5	111.1	149.8	-55.5	-19.7	0	0	0	122.5
902	L	28.4	Very low	26	Very low	159 Å²	159	139.6 Å²	139.6	83%	0.832	78%	0.775	S	S	*	*				-159.9	118.3	126.9	-143.7	72	0	0	0	113.5
903	I	24	Very low	25.9	Very low	140 Å²	140	141.5 Å²	141.5	72%	0.718	78%	0.777	S	S	*	*			trans	30.1	134.5	140	-47.6	174.7	0	0	0	119.7
904	H	25.2	Very low	25.6	Very low	170 Å²	170	141.7 Å²	141.7	79%	0.787	78%	0.781	S	S	*	*			trans	92.1	116.2	164.4	-90.5	-65.4	0	0	0	120.7
905	S	24.1	Very low	25.3	Very low	106 Å²	106	145.3 Å²	145.3	74%	0.741	79%	0.791	S	S	*	*			trans	72.9	83	138.3	-55.8	0	0	0	0	119.7
906	A	22.9	Very low	25	Very low	108 Å²	108	148.4 Å²	148.4	89%	0.893	80%	0.801	S	S	*	*			trans	-106.9	62.1	161.4	0	0	0	0	0	112.4
907	S	22.6	Very low	24.7	Very low	113 Å²	113	149.4 Å²	149.4	79%	0.79	80%	0.801	S	S	*	*			trans	-122.4	75.7	169	-56.1	0	0	0	0	109.6
908	K	24.1	Very low	24.5	Very low	192 Å²	192	151.3 Å²	151.3	84%	0.835	81%	0.81	S	S	*	*			trans	-157.9	58.5	179.8	-127.1	168.4	-170.4	175	0	116
909	F	21.4	Very low	24	Very low	222 Å²	222	155.3 Å²	155.3	97%	0.974	82%	0.815	S	S	*	*			trans	-124.8	66.9	148.6	-89.9	-80.6	0	0	0	109.4
910	V	23.6	Very low	23.9	Very low	125 Å²	125	157.8 Å²	157.8	76%	0.758	82%	0.822	S	S	*	*			trans	-99.1	110.2	168.9	175.9	0	0	0	0	107.2	N912	V910-N912 PolarHBondContact O-N 3.26Å
911	L	23.1	Very low	23.7	Very low	147 Å²	147	162.9 Å²	162.9	77%	0.77	82%	0.824	S	S	*	*			trans	-61.9	129.4	167.1	-79.1	167.1	0	0	0	108.9	F913	L911-F913 PolarHBondContact O-N 3.46Å
912	N	22.2	Very low	23.7	Very low	164 Å²	164	158.3 Å²	158.3	88%	0.877	82%	0.815	S	S	*	*			trans	-78.8	83.6	-164.9	-146.7	16.6	0	0	0	110.7	V910	V910-N912 PolarHBondContact O-N 3.26Å
913	F	23.4	Very low	23.5	Very low	173 Å²	173	155.5 Å²	155.5	76%	0.759	81%	0.814	S	S	*	*			trans	-76.5	134.6	169.4	-78.8	-83.3	0	0	0	110.5	L911 K915	L911-F913 PolarHBondContact O-N 3.46Å; F913-K915 PolarHBondContact O-N 2.91Å; F913-K915 VanDerWaalsContact O-N 3.1Å
914	P	24.1	Very low	23.6	Very low	121 Å²	121	156.9 Å²	156.9	79%	0.786	82%	0.823	S	S	*	*			trans	-70.7	109.1	-179.6	28.2	-33.3	0	0	0	110.8	Q916	P914-Q916 PolarHBondContact O-N 3.04Å
915	K	22.7	Very low	23.5	Very low	204 Å²	204	158.1 Å²	158.1	89%	0.887	83%	0.827	S	S	*	*			trans	-65.4	94.2	166.3	-73.8	-175	175.7	-175	0	109.9	F913	F913-K915 PolarHBondContact O-N 2.91Å; F913-K915 VanDerWaalsContact O-N 3.1Å
916	Q	23.8	Very low	23.5	Very low	183 Å²	183	158.8 Å²	158.8	86%	0.855	83%	0.831	S	S	*	*			trans	-177.9	96	152.8	-105.5	166.9	29.8	0	0	111.3	P914	P914-Q916 PolarHBondContact O-N 3.04Å
917	Q	24.1	Very low	23.7	Very low	169 Å²	169	164.3 Å²	164.3	79%	0.79	83%	0.829	S	S	*	*				-174.6	104.1	129.1	-103.1	167.4	-5.5	0	0	109.9
918	F	24.8	Very low	23.7	Very low	200 Å²	200	167.6 Å²	167.6	88%	0.877	83%	0.832	S	S	*	*			trans	-70.1	143.8	166.5	-93.3	-102.3	0	0	0	109.8	Q920	F918-Q920 PolarHBondContact O-N 2.81Å
919	F	24	Very low	23.9	Very low	210 Å²	210	166.4 Å²	166.4	92%	0.921	83%	0.829	S	S	*	*			trans	-66.4	116.9	159.6	-80.8	-95.5	0	0	0	108.7
920	Q	23.5	Very low	24.1	Very low	176 Å²	176	164 Å²	164	82%	0.822	82%	0.821	S	S	*	*			trans	-152.7	95.1	166.8	-154.4	166	20.7	0	0	110.3	F918	F918-Q920 PolarHBondContact O-N 2.81Å
921	F	22.3	Very low	24.2	Very low	179 Å²	179	164.8 Å²	164.8	79%	0.785	83%	0.826	S	S	*	*			trans	-79	122.9	154.3	-92.8	-94.2	0	0	0	107.1
922	G	23.6	Very low	24.5	Very low	64 Å²	64	161 Å²	161	66%	0.66	82%	0.823	S	S	*	*			trans	169	116.4	-178.3	0	0	0	0	0	113.9
923	A	24.2	Very low	24.7	Very low	99 Å²	99	160.3 Å²	160.3	82%	0.818	82%	0.818	S	S	*	*			trans	-1.1	125.6	165.1	0	0	0	0	0	119.6
924	N	25.9	Very low	24.8	Very low	170 Å²	170	159.2 Å²	159.2	91%	0.909	82%	0.82	S	S	*	*			trans	-138.6	113.9	143	-99.7	-47.5	0	0	0	110.2
925	K	23.7	Very low	24.8	Very low	196 Å²	196	157.2 Å²	157.2	85%	0.852	81%	0.809	S	S	*	*			trans	-119.7	156.5	163.2	-99	-175.3	178.6	176.4	0	107.6
926	S	24.6	Very low	24.9	Very low	119 Å²	119	156.1 Å²	156.1	83%	0.832	80%	0.804	S	S	*	*			trans	56.1	99.7	171.1	53.3	0	0	0	0	117.9
927	R	26.3	Very low	25.2	Very low	224 Å²	224	155.4 Å²	155.4	85%	0.845	81%	0.806	S	S	*	*				-142.5	115.3	105.6	-155.8	168.4	-176.3	166.8	1	110
928	Q	23.8	Very low	25.3	Very low	183 Å²	183	155.9 Å²	155.9	86%	0.855	81%	0.805	S	S	*	*			trans	-81.5	136.7	159.7	-78.9	172.4	-67.3	0	0	107.7
929	Q	28.2	Very low	25.4	Very low	166 Å²	166	153.2 Å²	153.2	78%	0.776	80%	0.8	S	S	*	*			trans	-155.4	113.1	147.6	-115.5	168.4	-14.9	0	0	107.3
930	E	24.5	Very low	25.6	Very low	172 Å²	172	151.5 Å²	151.5	80%	0.804	80%	0.801	S	S	*	*			trans	-84.7	144.7	165.9	-64.9	177.7	122.6	0	0	108.5
931	T	26	Very low	25.7	Very low	142 Å²	142	152 Å²	152	87%	0.871	80%	0.8	S	S	*	*				155.2	150.4	116.7	45.4	0	0	0	0	112.4
932	G	28.9	Very low	25.9	Very low	68 Å²	68	150.9 Å²	150.9	70%	0.701	80%	0.801	S	S	*	*			trans	94.3	123.3	162.7	0	0	0	0	0	117.1
933	L	26.4	Very low	26.1	Very low	148 Å²	148	153.3 Å²	153.3	78%	0.775	80%	0.804	S	S	*	*			cis	171.2	143.1	-31.3	-105.3	162.2	0	0	0	106.4
934	L	25.2	Very low	26.1	Very low	151 Å²	151	154.3 Å²	154.3	79%	0.791	80%	0.804	S	S	*	*			trans	67.2	151.9	155.6	-64.3	161.6	0	0	0	117.5
935	S	24.8	Very low	26.2	Very low	79 Å²	79	149.9 Å²	149.9	55%	0.552	80%	0.799	S	S	*	*			cis	-160.5	145.5	-2.4	142.5	0	0	0	0	111.7
936	K	25.4	Very low	26.2	Very low	181 Å²	181	151.2 Å²	151.2	79%	0.787	81%	0.805	S	S	*	*			trans	36.5	122.8	147.5	-53.6	163.4	-169.5	159.8	0	118.8
937	N	28.8	Very low	26.3	Very low	168 Å²	168	148.7 Å²	148.7	90%	0.898	80%	0.797	S	S	*	*				-151.6	153.1	116.8	-117.7	-29.4	0	0	0	114.6
938	K	27.3	Very low	26.4	Very low	179 Å²	179	144.3 Å²	144.3	78%	0.778	80%	0.795	S	S	*	*			trans	-99.7	156.3	-177.4	-85.3	178.7	174.3	174.1	0	111.6
939	N	25.7	Very low	26.5	Very low	143 Å²	143	141.9 Å²	141.9	77%	0.765	79%	0.788	S	S	*	*			trans	68.3	109.1	157.8	-56	-17.5	0	0	0	117.8
940	N	29.8	Very low	26.6	Very low	175 Å²	175	138.3 Å²	138.3	94%	0.936	78%	0.781	S	S	*	*				-150.4	158	107.1	-106.1	-26.4	0	0	0	112.3
941	K	24.7	Very low	27.1	Very low	186 Å²	186	136.5 Å²	136.5	81%	0.809	78%	0.777	S	S	*	*			trans	-133.4	116.6	-165.1	171.6	-168.7	-176.2	-178.1	0	108.1
942	L	27.4	Very low	27.5	Very low	156 Å²	156	138.1 Å²	138.1	82%	0.817	78%	0.78	S	S	*	*			trans	-173.5	152.8	145.5	-123.9	69	0	0	0	114.3
943	T	26.9	Very low	28.5	Very low	115 Å²	115	139.2 Å²	139.2	71%	0.706	77%	0.773	S	S	*	*			trans	59.9	88.9	154.7	53.1	0	0	0	0	121.8
944	S	24.1	Very low	29.9	Very low	119 Å²	119	136.4 Å²	136.4	83%	0.832	76%	0.758	S	S	*	*				45.5	106.7	119.4	62.8	0	0	0	0	120.9
945	G	27.3	Very low	32	Very low	77 Å²	77	133.8 Å²	133.8	79%	0.794	75%	0.75	S	S	*	*			trans	-160	99.3	154.3	0	0	0	0	0	110.8	G947	G945-G947 PolarHBondContact O-N 2.8Å; G945-G947 VanDerWaalsContact O-N 3.13Å
946	K	24.5	Very low	34.2	Very low	225 Å²	225	137.1 Å²	137.1	98%	0.978	76%	0.757	S	S	*	*			trans	-80.2	87.8	173.7	-82	-174.4	173.5	-177.7	0	109.6
947	G	27	Very low	36.7	Very low	65 Å²	65	133.2 Å²	133.2	67%	0.67	74%	0.742	S	S	*	*			trans	-107.7	121.6	164.3	0	0	0	0	0	109.6	G945 D949	G945-G947 PolarHBondContact O-N 2.8Å; G945-G947 VanDerWaalsContact O-N 3.13Å; G947-D949 PolarHBondContact O-N 3.12Å
948	V	27.2	Very low	39.3	Very low	133 Å²	133	126 Å²	126	81%	0.806	71%	0.705	S	S	*	*			trans	-93.1	87.2	175.5	-179.3	0	0	0	0	108.4
949	D	25.9	Very low	42.2	Very low	131 Å²	131	124.6 Å²	124.6	70%	0.701	70%	0.696	S	S	*	*			trans	-127.5	98.8	165.9	-84.1	-53.8	0	0	0	108.8	K864 G947	K864-D949 IonicContact NZ-OD1 3.39Å; K864-D949 PolarHBondContact NZ-OD1 3.09Å; G947-D949 PolarHBondContact O-N 3.12Å
950	S	30.4	Very low	45.3	Very low	91 Å²	91	119.9 Å²	119.9	64%	0.636	68%	0.677	S	S	*	*			trans	-107.2	150.5	178.4	58.3	0	0	0	0	111.6
951	N	35.1	Very low	48.3	Very low	135 Å²	135	112.1 Å²	112.1	72%	0.722	64%	0.635	S	S	*	*			trans	108.6	53.3	160.5	-53	-9.4	0	0	0	116.9	V953	N951-V953 HydrophobicContact CB-CG2 4.42Å
952	L	35.3	Very low	51.5	Low	176 Å²	176	104.5 Å²	104.5	92%	0.921	60%	0.602	S	S	*	*	S	Bend		-80.9	111.3	122.9	-161.8	79	0	0	0	106	N954	L952-N954 PolarHBondContact O-N 3.37Å; L952-N954 VanDerWaalsContact O-N 3.08Å
953	V	49.1	Very low	54.6	Low	91 Å²	91	100.7 Å²	100.7	55%	0.552	58%	0.58	S	S	*	*			trans	-73.8	104.9	-175.5	-179.6	0	0	0	0	109	N951	N951-V953 HydrophobicContact CB-CG2 4.42Å
954	N	56.5	Low	57.8	Low	88 Å²	88	96.7 Å²	96.7	47%	0.471	55%	0.553	S	S	.	*			trans	-64.9	129.3	175.5	-166	23.9	0	0	0	109	L952 E956 Q957 S958	L952-N954 PolarHBondContact O-N 3.37Å; L952-N954 VanDerWaalsContact O-N 3.08Å; N954-E956 PolarHBondContact ND2-OE2 2.96Å; N954-E956 PolarHBondContact O-N 2.57Å; N954-Q957 HydrophobicContact CB-CB 4.28Å; N954-Q957 WeakPolarHBondContact O-CB 3.17Å; N954-Q957 PolarHBondContact O-N 3.19Å; N954-S958 PolarHBondContact O-N 2.67Å
955	P	69.4	Low	61.1	Low	97 Å²	97	91.1 Å²	91.1	63%	0.63	51%	0.514	S	S	*	.	H	α-helix	trans	-55.9	-37.5	-175.2	-28.7	36.2	0	0	0	113.8	Q957 S958 Y959	P955-Q957 VanDerWaalsContact C-N 3.29Å; P955-Q957 PolarHBondContact O-N 3.13Å; P955-S958 PolarHBondContact O-N 2.88Å; P955-Y959 PolarHBondContact O-N 2.79Å
956	E	70.6	Confident	64.3	Low	148 Å²	148	92 Å²	92	69%	0.692	49%	0.493	S	S	*	.	H	α-helix	trans	-58.7	-39	175.4	-59.7	178.8	141	0	0	112.6	N954 Y959 A960	N954-E956 PolarHBondContact ND2-OE2 2.96Å; N954-E956 PolarHBondContact O-N 2.57Å; E956-Y959 PolarHBondContact O-N 2.9Å; E956-A960 WeakPolarHBondContact O-CB 3.38Å; E956-A960 PolarHBondContact O-N 3.24Å
957	Q	78.8	Confident	67.5	Low	99 Å²	99	83.8 Å²	83.8	46%	0.463	46%	0.458	S	S	.	.	H	α-helix	trans	-67.1	-42.5	178.7	-175	60.9	46.8	0	0	110.4	N954 P955 Y959 A960 D961	N954-Q957 HydrophobicContact CB-CB 4.28Å; N954-Q957 WeakPolarHBondContact O-CB 3.17Å; N954-Q957 PolarHBondContact O-N 3.19Å; P955-Q957 VanDerWaalsContact C-N 3.29Å; P955-Q957 PolarHBondContact O-N 3.13Å; Q957-Y959 PolarHBondContact O-N 3.41Å; Q957-A960 PolarHBondContact O-N 2.84Å; Q957-D961 PolarHBondContact NE2-OD1 3.4Å; Q957-D961 PolarHBondContact NE2-OD2 3.43Å; Q957-D961 WeakPolarHBondContact O-CB 3.28Å; Q957-D961 VanDerWaalsContact O-CG 3.31Å; Q957-D961 PolarHBondContact O-N 2.99Å; Q957-D961 VanDerWaalsContact O-OD2 3.1Å
958	S	83.4	Confident	70.7	Confident	18 Å²	18	80.7 Å²	80.7	13%	0.126	43%	0.426	C	S	.	.	H	α-helix	trans	-65.2	-38.8	177.7	-167.7	0	0	0	0	112.4	N954 P955 D961 Q962 Y997	N954-S958 PolarHBondContact O-N 2.67Å; P955-S958 PolarHBondContact O-N 2.88Å; S958-D961 PolarHBondContact O-N 3.17Å; S958-Q962 WeakPolarHBondContact O-CB 3.5Å; S958-Q962 WeakPolarHBondContact O-CG 3.36Å; S958-Q962 PolarHBondContact O-N 2.85Å; S958-Y997 WeakPolarHBondContact CA-OH 3.42Å; S958-Y997 PolarHBondContact OG-OH 2.93Å; S958-Y997 VanDerWaalsContact OG-OH 3.12Å
959	Y	87.9	Confident	73.7	Confident	149 Å²	149	74.7 Å²	74.7	58%	0.584	39%	0.39	S	S	*	.	H	α-helix	trans	-63.8	-44.9	172.5	-173.8	-92.1	0	0	0	111.9	P955 E956 Q957 D961 Q962 E963	P955-Y959 PolarHBondContact O-N 2.79Å; E956-Y959 PolarHBondContact O-N 2.9Å; Q957-Y959 PolarHBondContact O-N 3.41Å; Y959-D961 VanDerWaalsContact C-N 3.29Å; Y959-D961 PolarHBondContact O-N 3.04Å; Y959-Q962 PolarHBondContact O-N 3Å; Y959-E963 WeakPolarHBondContact O-CB 3.31Å; Y959-E963 PolarHBondContact O-N 3.39Å
960	A	90.4	Very high	76.8	Confident	44 Å²	44	73.8 Å²	73.8	36%	0.364	38%	0.377	S	S	.	.	H	α-helix	trans	-63.5	-33	177.1	0	0	0	0	0	113.1	E956 Q957 F964	E956-A960 WeakPolarHBondContact O-CB 3.38Å; E956-A960 PolarHBondContact O-N 3.24Å; Q957-A960 PolarHBondContact O-N 2.84Å; A960-F964 WeakPolarHBondContact O-CB 3.37Å; A960-F964 PolarHBondContact O-N 3.06Å
961	D	92.5	Very high	79.7	Confident	12 Å²	12	70.8 Å²	70.8	6%	0.064	35%	0.352	C	S	.	.	H	α-helix	trans	-74.4	-39.9	174.1	-70.9	-40.2	0	0	0	111.8	Q957 S958 Y959 E963 F964 L965 R987 L991 Y997	Q957-D961 PolarHBondContact NE2-OD1 3.4Å; Q957-D961 PolarHBondContact NE2-OD2 3.43Å; Q957-D961 WeakPolarHBondContact O-CB 3.28Å; Q957-D961 VanDerWaalsContact O-CG 3.31Å; Q957-D961 PolarHBondContact O-N 2.99Å; Q957-D961 VanDerWaalsContact O-OD2 3.1Å; S958-D961 PolarHBondContact O-N 3.17Å; Y959-D961 VanDerWaalsContact C-N 3.29Å; Y959-D961 PolarHBondContact O-N 3.04Å; D961-E963 VanDerWaalsContact C-N 3.32Å; D961-E963 PolarHBondContact O-N 3.25Å; D961-F964 PolarHBondContact O-N 3.05Å; D961-L965 VanDerWaalsContact O-CG 3.32Å; D961-L965 WeakPolarHBondContact O-CG 3.47Å; D961-L965 PolarHBondContact O-N 2.88Å; D961-R987 IonicContact OD1-CZ 3.71Å; D961-R987 IonicContact OD1-NE 2.67Å; D961-R987 IonicContact OD1-NH2 2.87Å; D961-R987 PolarHBondContact OD1-NH2 3.5Å; D961-L991 HydrophobicContact CB-CD1 4.23Å; D961-L991 HydrophobicContact CB-CD2 3.85Å; D961-Y997 HydrophobicContact CB-CE1 4.05Å
962	Q	92	Very high	82.2	Confident	26 Å²	26	64.4 Å²	64.4	12%	0.121	32%	0.318	C	S	.	.	H	α-helix	trans	-62.1	-36.9	171.2	-77.1	-175.4	-3.3	0	0	112.8	S958 Y959 L965 R966 Y997 Y1000	S958-Q962 WeakPolarHBondContact O-CB 3.5Å; S958-Q962 WeakPolarHBondContact O-CG 3.36Å; S958-Q962 PolarHBondContact O-N 2.85Å; Y959-Q962 PolarHBondContact O-N 3Å; Q962-L965 PolarHBondContact O-N 3.5Å; Q962-R966 WeakPolarHBondContact O-CB 3.41Å; Q962-R966 PolarHBondContact O-N 3.05Å; Q962-Y997 HydrophobicContact CG-CE1 4.16Å; Q962-Y1000 HydrophobicContact CB-CE1 4.05Å; Q962-Y1000 HydrophobicContact CB-CE2 4.37Å; Q962-Y1000 HydrophobicContact CG-CD1 4.43Å; Q962-Y1000 HydrophobicContact CG-CD2 4.39Å; Q962-Y1000 HydrophobicContact CG-CE1 4.24Å; Q962-Y1000 HydrophobicContact CG-CE2 4.2Å; Q962-Y1000 HydrophobicContact CG-CG 4.5Å; Q962-Y1000 VanDerWaalsContact O-CE1 3.29Å; Q962-Y1000 WeakPolarHBondContact O-CE1 3.34Å; Q962-Y1000 PolarHBondContact O-OH 3.26Å
963	E	92	Very high	84.6	Confident	75 Å²	75	58.7 Å²	58.7	35%	0.35	29%	0.286	S	S	.	.	H	α-helix	trans	-73.8	-38.1	177.5	-167.4	58.8	-164.7	0	0	111.9	Y959 D961 L965 R966 E967	Y959-E963 WeakPolarHBondContact O-CB 3.31Å; Y959-E963 PolarHBondContact O-N 3.39Å; D961-E963 VanDerWaalsContact C-N 3.32Å; D961-E963 PolarHBondContact O-N 3.25Å; E963-L965 VanDerWaalsContact C-N 3.33Å; E963-L965 PolarHBondContact O-N 3.37Å; E963-R966 WeakPolarHBondContact O-CB 3.3Å; E963-R966 PolarHBondContact O-N 3.3Å; E963-R966 VanDerWaalsContact OE2-CD 3.3Å; E963-R966 WeakPolarHBondContact OE2-CD 3.39Å; E963-R966 IonicContact OE2-CZ 3.16Å; E963-R966 IonicContact OE2-NE 2.67Å; E963-R966 PolarHBondContact OE2-NE 3.39Å; E963-E967 PolarHBondContact O-N 3.07Å
964	F	94.7	Very high	86.5	Confident	32 Å²	32	58.5 Å²	58.5	14%	0.14	28%	0.28	C	S	.	.	H	α-helix	trans	-56.9	-45.2	169.3	170.5	-98.2	0	0	0	111.9	A960 D961 E967 V968 F983 R987 L988 L991	A960-F964 WeakPolarHBondContact O-CB 3.37Å; A960-F964 PolarHBondContact O-N 3.06Å; D961-F964 PolarHBondContact O-N 3.05Å; F964-E967 PolarHBondContact O-N 3.29Å; F964-V968 HydrophobicContact CE1-CG2 4.37Å; F964-V968 HydrophobicContact CZ-CG2 4.33Å; F964-V968 WeakPolarHBondContact O-CG2 3.5Å; F964-V968 PolarHBondContact O-N 3.14Å; F964-V968 VanDerWaalsContact O-N 3.12Å; F964-F983 HydrophobicContact CD2-CD1 4.46Å; F964-F983 AromaticContact CE2-CD1 3.82Å; F964-F983 HydrophobicContact CE2-CD1 3.82Å; F964-F983 HydrophobicContact CZ-CB 4.44Å; F964-F983 HydrophobicContact CZ-CD1 4.31Å; F964-R987 HydrophobicContact CE1-CG 4.39Å; F964-L988 HydrophobicContact CE1-CD1 4.23Å; F964-L991 HydrophobicContact CD1-CD1 3.72Å; F964-L991 HydrophobicContact CE1-CD1 4Å
965	L	93.8	Very high	87.6	Confident	1 Å²	1	54.6 Å²	54.6	1%	0.005	26%	0.26	C	S	.	.	H	α-helix	trans	-67.5	-36.5	176.6	-65.4	170.1	0	0	0	112.2	D961 Q962 E963 V968 V969 L988 L991 Y997 Y1000 L1001	D961-L965 VanDerWaalsContact O-CG 3.32Å; D961-L965 WeakPolarHBondContact O-CG 3.47Å; D961-L965 PolarHBondContact O-N 2.88Å; Q962-L965 PolarHBondContact O-N 3.5Å; E963-L965 VanDerWaalsContact C-N 3.33Å; E963-L965 PolarHBondContact O-N 3.37Å; L965-V968 PolarHBondContact O-N 3.16Å; L965-V969 WeakPolarHBondContact O-CG2 3.42Å; L965-V969 PolarHBondContact O-N 3.31Å; L965-L988 HydrophobicContact CD2-CD1 3.73Å; L965-L991 HydrophobicContact CD2-CD1 4.46Å; L965-Y997 HydrophobicContact CD1-CD1 3.6Å; L965-Y997 HydrophobicContact CD1-CE1 4.5Å; L965-Y997 HydrophobicContact CD1-CG 3.99Å; L965-Y1000 HydrophobicContact CB-CD1 4.21Å; L965-Y1000 HydrophobicContact CB-CE1 4.05Å; L965-Y1000 HydrophobicContact CD1-CD1 4.16Å; L965-L1001 HydrophobicContact CB-CD1 4.36Å; L965-L1001 HydrophobicContact CD2-CD1 4.2Å
966	R	93.3	Very high	88.3	Confident	95 Å²	95	53.6 Å²	53.6	36%	0.358	25%	0.247	S	C	.	.	H	α-helix	trans	-61.8	-44.6	175.2	-168.2	-171	-55.4	-113.1	-11.2	111.4	Q962 E963 V969 R970 Y1000	Q962-R966 WeakPolarHBondContact O-CB 3.41Å; Q962-R966 PolarHBondContact O-N 3.05Å; E963-R966 WeakPolarHBondContact O-CB 3.3Å; E963-R966 PolarHBondContact O-N 3.3Å; E963-R966 VanDerWaalsContact OE2-CD 3.3Å; E963-R966 WeakPolarHBondContact OE2-CD 3.39Å; E963-R966 IonicContact OE2-CZ 3.16Å; E963-R966 IonicContact OE2-NE 2.67Å; E963-R966 PolarHBondContact OE2-NE 3.39Å; R966-V969 PolarHBondContact O-N 3.12Å; R966-R970 PolarHBondContact O-N 2.79Å; R966-Y1000 PolarHBondContact NH2-OH 3.18Å; R966-Y1000 VanDerWaalsContact NH2-OH 3.1Å
967	E	93.1	Very high	88.7	Confident	53 Å²	53	49.2 Å²	49.2	25%	0.248	24%	0.236	C	C	.	.	H	α-helix	trans	-62.6	-42.4	175.9	-168.6	71.3	176.1	0	0	111.1	E963 F964 V969 R970 Y971 F983	E963-E967 PolarHBondContact O-N 3.07Å; F964-E967 PolarHBondContact O-N 3.29Å; E967-V969 PolarHBondContact O-N 2.63Å; E967-R970 PolarHBondContact O-N 3.16Å; E967-R970 IonicContact OE1-CZ 2.73Å; E967-R970 IonicContact OE1-NH1 3.51Å; E967-R970 IonicContact OE1-NH2 2.81Å; E967-R970 PolarHBondContact OE1-NH2 2.67Å; E967-R970 IonicContact OE2-CZ 2.62Å; E967-R970 IonicContact OE2-NH1 3.54Å; E967-R970 PolarHBondContact OE2-NH1 3.19Å; E967-R970 IonicContact OE2-NH2 3.75Å; E967-R970 PolarHBondContact OE2-NH2 3Å; E967-Y971 HydrophobicContact CG-CD2 4.21Å; E967-Y971 HydrophobicContact CG-CE2 4.17Å; E967-Y971 VanDerWaalsContact O-CD2 3.31Å; E967-Y971 WeakPolarHBondContact O-CD2 3.42Å; E967-Y971 PolarHBondContact O-N 3.24Å; E967-Y971 VanDerWaalsContact O-N 3.11Å; E967-Y971 WeakPolarHBondContact OE1-CE2 3.33Å; E967-F983 HydrophobicContact CB-CE1 4.3Å; E967-F983 HydrophobicContact CG-CE1 3.98Å; E967-F983 HydrophobicContact CG-CZ 3.98Å
968	V	92.9	Very high	88.7	Confident	0 Å²	0	49.7 Å²	49.7	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-57	-48.5	174.3	171.7	0	0	0	0	111.4	F964 L965 Y971 I972 F983 W1036 L1037	F964-V968 HydrophobicContact CE1-CG2 4.37Å; F964-V968 HydrophobicContact CZ-CG2 4.33Å; F964-V968 WeakPolarHBondContact O-CG2 3.5Å; F964-V968 PolarHBondContact O-N 3.14Å; F964-V968 VanDerWaalsContact O-N 3.12Å; L965-V968 PolarHBondContact O-N 3.16Å; V968-Y971 PolarHBondContact O-N 3.23Å; V968-I972 HydrophobicContact CG1-CD1 3.92Å; V968-I972 WeakPolarHBondContact O-CG1 3.43Å; V968-I972 PolarHBondContact O-N 3.28Å; V968-F983 HydrophobicContact CG2-CB 4.21Å; V968-F983 HydrophobicContact CG2-CD1 3.44Å; V968-F983 VanDerWaalsContact CG2-CD1 3.44Å; V968-F983 HydrophobicContact CG2-CD2 4.07Å; V968-F983 HydrophobicContact CG2-CE1 3.68Å; V968-F983 HydrophobicContact CG2-CE2 4.29Å; V968-F983 HydrophobicContact CG2-CG 3.65Å; V968-F983 HydrophobicContact CG2-CZ 4.1Å; V968-W1036 HydrophobicContact CG1-CZ3 4.39Å; V968-L1037 HydrophobicContact CG1-CD1 4.2Å; V968-L1037 HydrophobicContact CG1-CD2 4.45Å
969	V	91.7	Very high	88.7	Confident	8 Å²	8	48.9 Å²	48.9	5%	0.048	24%	0.236	C	C	.	.	H	α-helix	trans	-63.3	-42.8	178.9	175.1	0	0	0	0	111.3	L965 R966 E967 Y971 I972 H973 L1001 K1004 L1005	L965-V969 WeakPolarHBondContact O-CG2 3.42Å; L965-V969 PolarHBondContact O-N 3.31Å; R966-V969 PolarHBondContact O-N 3.12Å; E967-V969 PolarHBondContact O-N 2.63Å; V969-Y971 VanDerWaalsContact C-N 3.32Å; V969-Y971 PolarHBondContact O-N 3.38Å; V969-I972 PolarHBondContact O-N 3.11Å; V969-H973 PolarHBondContact O-N 3.34Å; V969-L1001 HydrophobicContact CG2-CD1 3.51Å; V969-K1004 HydrophobicContact CB-CB 4.49Å; V969-K1004 HydrophobicContact CG1-CB 4.07Å; V969-K1004 HydrophobicContact CG2-CB 4.22Å; V969-L1005 HydrophobicContact CG1-CD1 4.35Å
970	R	90.9	Very high	88.4	Confident	111 Å²	111	44.3 Å²	44.3	42%	0.419	22%	0.22	S	C	.	.	H	α-helix	trans	-57.7	-44.5	179	-154.7	-171.5	73.8	-125.7	-18.7	111.5	R966 E967 I972 H973 E974	R966-R970 PolarHBondContact O-N 2.79Å; E967-R970 PolarHBondContact O-N 3.16Å; E967-R970 IonicContact OE1-CZ 2.73Å; E967-R970 IonicContact OE1-NH1 3.51Å; E967-R970 IonicContact OE1-NH2 2.81Å; E967-R970 PolarHBondContact OE1-NH2 2.67Å; E967-R970 IonicContact OE2-CZ 2.62Å; E967-R970 IonicContact OE2-NH1 3.54Å; E967-R970 PolarHBondContact OE2-NH1 3.19Å; E967-R970 IonicContact OE2-NH2 3.75Å; E967-R970 PolarHBondContact OE2-NH2 3Å; R970-I972 VanDerWaalsContact C-N 3.28Å; R970-I972 PolarHBondContact O-N 2.97Å; R970-H973 PolarHBondContact O-N 2.73Å; R970-E974 WeakPolarHBondContact CD-OE1 3.38Å; R970-E974 WeakPolarHBondContact CG-OE1 3.39Å; R970-E974 IonicContact CZ-OE1 3.22Å; R970-E974 IonicContact NE-OE1 2.69Å; R970-E974 PolarHBondContact NE-OE1 2.94Å; R970-E974 IonicContact NH2-OE1 3.8Å; R970-E974 WeakPolarHBondContact O-CB 3.33Å; R970-E974 VanDerWaalsContact O-CG 3.25Å; R970-E974 WeakPolarHBondContact O-CG 3.33Å; R970-E974 PolarHBondContact O-N 2.97Å
971	Y	89.4	Confident	87.9	Confident	28 Å²	28	50 Å²	50	11%	0.11	24%	0.241	C	C	.	.	H	α-helix	trans	-62.8	-32.4	176.8	-90.6	-99.6	0	0	0	113.9	E967 V968 V969 G975 Q976 K982 F983	E967-Y971 HydrophobicContact CG-CD2 4.21Å; E967-Y971 HydrophobicContact CG-CE2 4.17Å; E967-Y971 VanDerWaalsContact O-CD2 3.31Å; E967-Y971 WeakPolarHBondContact O-CD2 3.42Å; E967-Y971 PolarHBondContact O-N 3.24Å; E967-Y971 VanDerWaalsContact O-N 3.11Å; E967-Y971 WeakPolarHBondContact OE1-CE2 3.33Å; V968-Y971 PolarHBondContact O-N 3.23Å; V969-Y971 VanDerWaalsContact C-N 3.32Å; V969-Y971 PolarHBondContact O-N 3.38Å; Y971-G975 PolarHBondContact O-N 2.88Å; Y971-Q976 HydrophobicContact CD1-CB 3.81Å; Y971-Q976 HydrophobicContact CD1-CG 3.73Å; Y971-Q976 HydrophobicContact CE1-CB 4.41Å; Y971-Q976 HydrophobicContact CE1-CG 4.04Å; Y971-Q976 VanDerWaalsContact CE1-OE1 3.23Å; Y971-Q976 HydrophobicContact CG-CG 4.49Å; Y971-Q976 PolarHBondContact O-N 3.43Å; Y971-Q976 VanDerWaalsContact O-N 3.15Å; Y971-K982 HydrophobicContact CD1-CD 4.2Å; Y971-K982 HydrophobicContact CE1-CD 3.8Å; Y971-K982 PolarHBondContact OH-NZ 3.13Å; Y971-F983 HydrophobicContact CD1-CE2 4.43Å; Y971-F983 HydrophobicContact CD2-CE2 4.2Å; Y971-F983 AromaticContact CD2-CZ 3.83Å; Y971-F983 HydrophobicContact CD2-CZ 3.83Å; Y971-F983 HydrophobicContact CE2-CZ 4.43Å; Y971-F983 AromaticContact CG-CE2 3.92Å; Y971-F983 HydrophobicContact CG-CE2 3.92Å; Y971-F983 HydrophobicContact CG-CZ 4.04Å
972	I	89.3	Confident	87.6	Confident	2 Å²	2	55.2 Å²	55.2	1%	0.01	26%	0.263	C	S	.	.	H	α-helix	trans	-75.7	-43.6	179.5	-67.7	170.3	0	0	0	110.9	V968 V969 R970 G975 V979 L1005 H1034 L1037	V968-I972 HydrophobicContact CG1-CD1 3.92Å; V968-I972 WeakPolarHBondContact O-CG1 3.43Å; V968-I972 PolarHBondContact O-N 3.28Å; V969-I972 PolarHBondContact O-N 3.11Å; R970-I972 VanDerWaalsContact C-N 3.28Å; R970-I972 PolarHBondContact O-N 2.97Å; I972-G975 PolarHBondContact O-N 2.8Å; I972-G975 VanDerWaalsContact O-N 3.11Å; I972-V979 HydrophobicContact CG1-CG1 4.18Å; I972-L1005 HydrophobicContact CG2-CD1 3.94Å; I972-H1034 WeakPolarHBondContact CG2-CE1 3.34Å; I972-H1034 VanDerWaalsContact CG2-ND1 3.31Å; I972-H1034 WeakPolarHBondContact CG2-ND1 3.21Å; I972-L1037 HydrophobicContact CD1-CB 4.04Å; I972-L1037 HydrophobicContact CD1-CD2 3.4Å; I972-L1037 VanDerWaalsContact CD1-CD2 3.4Å; I972-L1037 HydrophobicContact CD1-CG 4.26Å
973	H	86.1	Confident	87.5	Confident	55 Å²	55	54.8 Å²	54.8	26%	0.255	26%	0.261	S	S	.	.	H	α-helix	trans	-68.5	-35.6	174.3	-72.8	167	0	0	0	112.8	V969 R970 G975 K1004 L1005 I1026	V969-H973 PolarHBondContact O-N 3.34Å; R970-H973 PolarHBondContact O-N 2.73Å; H973-G975 PolarHBondContact O-N 2.84Å; H973-G975 VanDerWaalsContact O-N 3.16Å; H973-K1004 PolarHBondContact CE1-O 3.13Å; H973-L1005 PolarHBondContact NE2-O 3.22Å; H973-I1026 WeakPolarHBondContact O-CD1 3.29Å
974	E	87	Confident	87.4	Confident	88 Å²	88	54.2 Å²	54.2	41%	0.411	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-11.9	169.8	-74.9	173.3	-154.1	0	0	113.1	R970 Q976	R970-E974 WeakPolarHBondContact CD-OE1 3.38Å; R970-E974 WeakPolarHBondContact CG-OE1 3.39Å; R970-E974 IonicContact CZ-OE1 3.22Å; R970-E974 IonicContact NE-OE1 2.69Å; R970-E974 PolarHBondContact NE-OE1 2.94Å; R970-E974 IonicContact NH2-OE1 3.8Å; R970-E974 WeakPolarHBondContact O-CB 3.33Å; R970-E974 VanDerWaalsContact O-CG 3.25Å; R970-E974 WeakPolarHBondContact O-CG 3.33Å; R970-E974 PolarHBondContact O-N 2.97Å; E974-Q976 VanDerWaalsContact C-N 3.29Å; E974-Q976 HydrophobicContact CB-CG 3.85Å; E974-Q976 PolarHBondContact O-N 2.86Å; E974-Q976 PolarHBondContact OE2-NE2 3.15Å
975	G	81.3	Confident	87.2	Confident	6 Å²	6	55 Å²	55	6%	0.062	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	64.7	31.5	-179.5	0	0	0	0	0	113.3	Y971 I972 H973 N1027 N1029	Y971-G975 PolarHBondContact O-N 2.88Å; I972-G975 PolarHBondContact O-N 2.8Å; I972-G975 VanDerWaalsContact O-N 3.11Å; H973-G975 PolarHBondContact O-N 2.84Å; H973-G975 VanDerWaalsContact O-N 3.16Å; G975-N1027 PolarHBondContact O-ND2 3.31Å; G975-N1027 VanDerWaalsContact O-ND2 3.1Å; G975-N1027 PolarHBondContact O-OD1 3.41Å; G975-N1029 WeakPolarHBondContact O-CB 3.38Å
976	Q	82.3	Confident	87.1	Confident	75 Å²	75	58.9 Å²	58.9	35%	0.35	29%	0.293	S	S	.	.			trans	-66.9	148.1	-178.6	-65.9	-129.2	7.9	0	0	112	Y971 E974 V979	Y971-Q976 HydrophobicContact CD1-CB 3.81Å; Y971-Q976 HydrophobicContact CD1-CG 3.73Å; Y971-Q976 HydrophobicContact CE1-CB 4.41Å; Y971-Q976 HydrophobicContact CE1-CG 4.04Å; Y971-Q976 VanDerWaalsContact CE1-OE1 3.23Å; Y971-Q976 HydrophobicContact CG-CG 4.49Å; Y971-Q976 PolarHBondContact O-N 3.43Å; Y971-Q976 VanDerWaalsContact O-N 3.15Å; E974-Q976 VanDerWaalsContact C-N 3.29Å; E974-Q976 HydrophobicContact CB-CG 3.85Å; E974-Q976 PolarHBondContact O-N 2.86Å; E974-Q976 PolarHBondContact OE2-NE2 3.15Å; Q976-V979 HydrophobicContact CB-CG2 4.44Å
977	A	80.2	Confident	87.1	Confident	56 Å²	56	58.6 Å²	58.6	46%	0.463	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.6	151.3	174.7	0	0	0	0	0	111.8	V979	A977-V979 VanDerWaalsContact C-N 3.33Å; A977-V979 PolarHBondContact O-N 3.3Å
978	N	79.3	Confident	87.1	Confident	110 Å²	110	56 Å²	56	59%	0.588	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.6	30.7	169.7	-58.1	-34.8	0	0	0	116.2	Q980 M981	N978-Q980 PolarHBondContact O-N 2.95Å; N978-Q980 VanDerWaalsContact O-N 3.13Å; N978-M981 HydrophobicContact CB-CB 4.39Å; N978-M981 HydrophobicContact CB-CG 4.32Å; N978-M981 WeakPolarHBondContact O-CB 3.29Å; N978-M981 PolarHBondContact O-N 3.35Å
979	V	82.4	Confident	87.1	Confident	1 Å²	1	59.3 Å²	59.3	1%	0.006	29%	0.294	C	S	.	.	H	α-helix	trans	-46.4	-44.8	176.2	178.2	0	0	0	0	112.3	I972 Q976 A977 M981 K982 F983 S1033 W1036	I972-V979 HydrophobicContact CG1-CG1 4.18Å; Q976-V979 HydrophobicContact CB-CG2 4.44Å; A977-V979 VanDerWaalsContact C-N 3.33Å; A977-V979 PolarHBondContact O-N 3.3Å; V979-M981 PolarHBondContact O-N 3.33Å; V979-M981 VanDerWaalsContact O-N 3.15Å; V979-K982 WeakPolarHBondContact O-CB 3.41Å; V979-K982 PolarHBondContact O-N 3.28Å; V979-F983 HydrophobicContact CG1-CD2 3.67Å; V979-F983 HydrophobicContact CG1-CE2 3.87Å; V979-F983 WeakPolarHBondContact O-CD2 3.46Å; V979-F983 PolarHBondContact O-N 3.37Å; V979-S1033 WeakPolarHBondContact CG2-OG 3.45Å; V979-W1036 HydrophobicContact CG1-CE3 4.43Å; V979-W1036 HydrophobicContact CG1-CZ3 3.93Å
980	Q	80.9	Confident	87.2	Confident	52 Å²	52	65.6 Å²	65.6	24%	0.243	32%	0.323	C	S	.	.	H	α-helix	trans	-58	-21.3	176.3	67.4	-157.2	9.7	0	0	116.4	N978 W1036 L1115	N978-Q980 PolarHBondContact O-N 2.95Å; N978-Q980 VanDerWaalsContact O-N 3.13Å; Q980-W1036 HydrophobicContact CB-CD2 3.99Å; Q980-W1036 HydrophobicContact CB-CG 4.06Å; Q980-W1036 HydrophobicContact CB-CZ2 4.25Å; Q980-L1115 HydrophobicContact CB-CD2 4.46Å; Q980-L1115 HydrophobicContact CG-CD2 4.11Å
981	M	81.4	Confident	87.3	Confident	164 Å²	164	61.2 Å²	61.2	81%	0.808	31%	0.308	S	S	*	.	H	α-helix	trans	-86.3	-22.8	173.3	-70.1	-77.8	-159.4	0	0	112	N978 V979	N978-M981 HydrophobicContact CB-CB 4.39Å; N978-M981 HydrophobicContact CB-CG 4.32Å; N978-M981 WeakPolarHBondContact O-CB 3.29Å; N978-M981 PolarHBondContact O-N 3.35Å; V979-M981 PolarHBondContact O-N 3.33Å; V979-M981 VanDerWaalsContact O-N 3.15Å
982	K	85.7	Confident	87.6	Confident	121 Å²	121	59.9 Å²	59.9	53%	0.526	30%	0.303	S	S	.	.	H	α-helix	trans	-87.2	-33.6	-175.3	-176.2	166.1	-177.8	161.9	0	112.7	Y971 V979	Y971-K982 HydrophobicContact CD1-CD 4.2Å; Y971-K982 HydrophobicContact CE1-CD 3.8Å; Y971-K982 PolarHBondContact OH-NZ 3.13Å; V979-K982 WeakPolarHBondContact O-CB 3.41Å; V979-K982 PolarHBondContact O-N 3.28Å
983	F	90	Very high	87.7	Confident	18 Å²	18	62.6 Å²	62.6	8%	0.079	32%	0.322	C	S	.	.	S	Bend	trans	-111.3	142.2	-176.2	-59.9	-81.4	0	0	0	112	F964 E967 V968 Y971 V979 V985 W1036	F964-F983 HydrophobicContact CD2-CD1 4.46Å; F964-F983 AromaticContact CE2-CD1 3.82Å; F964-F983 HydrophobicContact CE2-CD1 3.82Å; F964-F983 HydrophobicContact CZ-CB 4.44Å; F964-F983 HydrophobicContact CZ-CD1 4.31Å; E967-F983 HydrophobicContact CB-CE1 4.3Å; E967-F983 HydrophobicContact CG-CE1 3.98Å; E967-F983 HydrophobicContact CG-CZ 3.98Å; V968-F983 HydrophobicContact CG2-CB 4.21Å; V968-F983 HydrophobicContact CG2-CD1 3.44Å; V968-F983 VanDerWaalsContact CG2-CD1 3.44Å; V968-F983 HydrophobicContact CG2-CD2 4.07Å; V968-F983 HydrophobicContact CG2-CE1 3.68Å; V968-F983 HydrophobicContact CG2-CE2 4.29Å; V968-F983 HydrophobicContact CG2-CG 3.65Å; V968-F983 HydrophobicContact CG2-CZ 4.1Å; Y971-F983 HydrophobicContact CD1-CE2 4.43Å; Y971-F983 HydrophobicContact CD2-CE2 4.2Å; Y971-F983 AromaticContact CD2-CZ 3.83Å; Y971-F983 HydrophobicContact CD2-CZ 3.83Å; Y971-F983 HydrophobicContact CE2-CZ 4.43Å; Y971-F983 AromaticContact CG-CE2 3.92Å; Y971-F983 HydrophobicContact CG-CE2 3.92Å; Y971-F983 HydrophobicContact CG-CZ 4.04Å; V979-F983 HydrophobicContact CG1-CD2 3.67Å; V979-F983 HydrophobicContact CG1-CE2 3.87Å; V979-F983 WeakPolarHBondContact O-CD2 3.46Å; V979-F983 PolarHBondContact O-N 3.37Å; F983-V985 PolarHBondContact O-N 2.7Å; F983-W1036 HydrophobicContact CB-CH2 4.13Å
984	S	90.6	Very high	87.9	Confident	63 Å²	63	61.7 Å²	61.7	44%	0.441	32%	0.319	S	S	.	.			trans	-72.8	109.7	-179.8	177.6	0	0	0	0	111.4	N986 R987 L988	S984-N986 PolarHBondContact O-N 2.86Å; S984-R987 PolarHBondContact O-N 3.33Å; S984-R987 PolarHBondContact OG-N 3.06Å; S984-L988 WeakPolarHBondContact O-CB 3.48Å; S984-L988 PolarHBondContact O-N 2.95Å
985	V	89.7	Confident	88.2	Confident	47 Å²	47	59 Å²	59	29%	0.285	31%	0.306	S	S	.	.	H	α-helix	trans	-53.6	-38.9	174.8	-179.6	0	0	0	0	111.8	F983 L988 K989 W1036	F983-V985 PolarHBondContact O-N 2.7Å; V985-L988 PolarHBondContact O-N 3.37Å; V985-K989 HydrophobicContact CG1-CD 4.17Å; V985-K989 HydrophobicContact CG1-CG 4.45Å; V985-K989 WeakPolarHBondContact O-CB 3.08Å; V985-K989 WeakPolarHBondContact O-CG 3.42Å; V985-K989 PolarHBondContact O-N 3.07Å; V985-W1036 HydrophobicContact CG2-CZ2 3.87Å
986	N	91.5	Very high	88.7	Confident	83 Å²	83	63.5 Å²	63.5	44%	0.444	33%	0.329	S	S	.	.	H	α-helix	trans	-69.5	-47.2	-177.6	-65.6	-12.4	0	0	0	111.5	S984 L988 K989 E990	S984-N986 PolarHBondContact O-N 2.86Å; N986-L988 VanDerWaalsContact C-N 3.26Å; N986-L988 PolarHBondContact O-N 2.92Å; N986-K989 PolarHBondContact O-N 2.84Å; N986-E990 WeakPolarHBondContact O-CG 3.41Å; N986-E990 PolarHBondContact O-N 3.09Å
987	R	94	Very high	89.4	Confident	89 Å²	89	61 Å²	61	34%	0.336	32%	0.317	S	S	.	.	H	α-helix	trans	-59.9	-40.2	174.8	-176.6	179.7	179.9	-172.9	-1.3	110.9	D961 F964 S984 E990 L991	D961-R987 IonicContact OD1-CZ 3.71Å; D961-R987 IonicContact OD1-NE 2.67Å; D961-R987 IonicContact OD1-NH2 2.87Å; D961-R987 PolarHBondContact OD1-NH2 3.5Å; F964-R987 HydrophobicContact CE1-CG 4.39Å; S984-R987 PolarHBondContact O-N 3.33Å; S984-R987 PolarHBondContact OG-N 3.06Å; R987-E990 PolarHBondContact O-N 2.65Å; R987-L991 HydrophobicContact CG-CD1 4.1Å; R987-L991 HydrophobicContact CG-CG 4.42Å; R987-L991 WeakPolarHBondContact O-CB 3.36Å; R987-L991 WeakPolarHBondContact O-CG 3.38Å; R987-L991 PolarHBondContact O-N 3.39Å
988	L	92.8	Very high	90.1	Very high	0 Å²	0	58.4 Å²	58.4	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-64.5	-45	178.5	-171.1	65.6	0	0	0	111.7	F964 L965 S984 V985 N986 L991 L992 W1036 L1037 C1040	F964-L988 HydrophobicContact CE1-CD1 4.23Å; L965-L988 HydrophobicContact CD2-CD1 3.73Å; S984-L988 WeakPolarHBondContact O-CB 3.48Å; S984-L988 PolarHBondContact O-N 2.95Å; V985-L988 PolarHBondContact O-N 3.37Å; N986-L988 VanDerWaalsContact C-N 3.26Å; N986-L988 PolarHBondContact O-N 2.92Å; L988-L991 PolarHBondContact O-N 3.34Å; L988-L992 HydrophobicContact CD1-CD1 3.92Å; L988-L992 HydrophobicContact CD1-CG 4.34Å; L988-L992 HydrophobicContact CG-CD1 3.82Å; L988-L992 VanDerWaalsContact O-CB 3.3Å; L988-L992 WeakPolarHBondContact O-CB 3.49Å; L988-L992 WeakPolarHBondContact O-CG 3.36Å; L988-L992 PolarHBondContact O-N 3.3Å; L988-W1036 HydrophobicContact CD2-CH2 3.44Å; L988-W1036 VanDerWaalsContact CD2-CH2 3.44Å; L988-W1036 HydrophobicContact CD2-CZ2 3.86Å; L988-W1036 HydrophobicContact CD2-CZ3 3.91Å; L988-L1037 HydrophobicContact CD1-CD1 4.21Å; L988-L1037 HydrophobicContact CD2-CD1 3.75Å; L988-L1037 HydrophobicContact CG-CD1 4.38Å; L988-C1040 HydrophobicContact CD2-CB 4.03Å; L988-C1040 HydrophobicContact CG-CB 4.22Å
989	K	93.6	Very high	90.7	Very high	69 Å²	69	54 Å²	54	30%	0.3	27%	0.271	S	S	.	.	H	α-helix	trans	-64.7	-35.6	174.9	-77.2	-178.5	172.8	-167.2	0	113.5	V985 N986 S993 C1040 H1043	V985-K989 HydrophobicContact CG1-CD 4.17Å; V985-K989 HydrophobicContact CG1-CG 4.45Å; V985-K989 WeakPolarHBondContact O-CB 3.08Å; V985-K989 WeakPolarHBondContact O-CG 3.42Å; V985-K989 PolarHBondContact O-N 3.07Å; N986-K989 PolarHBondContact O-N 2.84Å; K989-S993 PolarHBondContact O-N 3.11Å; K989-C1040 HydrophobicContact CG-CB 4.27Å; K989-H1043 HydrophobicContact CD-CB 4.49Å; K989-H1043 HydrophobicContact CG-CB 4.46Å
990	E	92.6	Very high	91.3	Very high	139 Å²	139	54.2 Å²	54.2	65%	0.65	27%	0.272	S	S	*	.	H	α-helix	trans	-66.4	-50.7	174.5	-75.2	171.2	175	0	0	111	N986 R987 L992 S993	N986-E990 WeakPolarHBondContact O-CG 3.41Å; N986-E990 PolarHBondContact O-N 3.09Å; R987-E990 PolarHBondContact O-N 2.65Å; E990-L992 PolarHBondContact O-N 3.49Å; E990-S993 WeakPolarHBondContact O-CB 3.2Å; E990-S993 PolarHBondContact O-N 3.03Å; E990-S993 PolarHBondContact O-OG 3.41Å
991	L	94	Very high	91.9	Very high	19 Å²	19	51.8 Å²	51.8	10%	0.099	26%	0.261	C	S	.	.	H	α-helix	trans	-60.2	-44.7	177.1	-71.2	174.5	0	0	0	112	D961 F964 L965 R987 L988 S993 D994 Y997	D961-L991 HydrophobicContact CB-CD1 4.23Å; D961-L991 HydrophobicContact CB-CD2 3.85Å; F964-L991 HydrophobicContact CD1-CD1 3.72Å; F964-L991 HydrophobicContact CE1-CD1 4Å; L965-L991 HydrophobicContact CD2-CD1 4.46Å; R987-L991 HydrophobicContact CG-CD1 4.1Å; R987-L991 HydrophobicContact CG-CG 4.42Å; R987-L991 WeakPolarHBondContact O-CB 3.36Å; R987-L991 WeakPolarHBondContact O-CG 3.38Å; R987-L991 PolarHBondContact O-N 3.39Å; L988-L991 PolarHBondContact O-N 3.34Å; L991-S993 PolarHBondContact O-N 3.45Å; L991-S993 VanDerWaalsContact O-N 3.16Å; L991-D994 PolarHBondContact O-N 2.92Å; L991-D994 VanDerWaalsContact O-N 3.09Å; L991-Y997 HydrophobicContact CB-CD2 4.31Å; L991-Y997 HydrophobicContact CD2-CD2 4.01Å; L991-Y997 HydrophobicContact CD2-CE2 3.83Å; L991-Y997 WeakPolarHBondContact O-CB 3.11Å; L991-Y997 WeakPolarHBondContact O-CD2 3.3Å
992	L	94.3	Very high	92.5	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.5	1.2	-179.2	-63.3	174.3	0	0	0	114.2	L988 E990 R998 L1001 L1037 C1040 V1041 G1044	L988-L992 HydrophobicContact CD1-CD1 3.92Å; L988-L992 HydrophobicContact CD1-CG 4.34Å; L988-L992 HydrophobicContact CG-CD1 3.82Å; L988-L992 VanDerWaalsContact O-CB 3.3Å; L988-L992 WeakPolarHBondContact O-CB 3.49Å; L988-L992 WeakPolarHBondContact O-CG 3.36Å; L988-L992 PolarHBondContact O-N 3.3Å; E990-L992 PolarHBondContact O-N 3.49Å; L992-R998 HydrophobicContact CB-CG 4.29Å; L992-R998 HydrophobicContact CD2-CG 4.11Å; L992-R998 WeakPolarHBondContact O-CD 3.25Å; L992-R998 VanDerWaalsContact O-CG 3.32Å; L992-R998 WeakPolarHBondContact O-CG 3.2Å; L992-R998 PolarHBondContact O-NH1 3.45Å; L992-L1001 HydrophobicContact CD1-CD2 3.93Å; L992-L1001 HydrophobicContact CD2-CB 4.25Å; L992-L1001 HydrophobicContact CD2-CD2 3.56Å; L992-L1001 HydrophobicContact CG-CD2 4.38Å; L992-L1037 HydrophobicContact CD1-CD1 4.44Å; L992-C1040 HydrophobicContact CD1-CB 3.93Å; L992-V1041 HydrophobicContact CD1-CG2 3.89Å; L992-G1044 VanDerWaalsContact O-CA 3.25Å; L992-G1044 WeakPolarHBondContact O-CA 3.36Å
993	S	91.6	Very high	92.8	Very high	60 Å²	60	39.5 Å²	39.5	42%	0.42	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.2	-24.5	163.4	71.7	0	0	0	0	112.3	K989 E990 L991 R998	K989-S993 PolarHBondContact O-N 3.11Å; E990-S993 WeakPolarHBondContact O-CB 3.2Å; E990-S993 PolarHBondContact O-N 3.03Å; E990-S993 PolarHBondContact O-OG 3.41Å; L991-S993 PolarHBondContact O-N 3.45Å; L991-S993 VanDerWaalsContact O-N 3.16Å; S993-R998 PolarHBondContact O-NH1 2.76Å
994	D	90.8	Very high	92.8	Very high	35 Å²	35	40.4 Å²	40.4	19%	0.187	21%	0.21	C	C	.	.	S	Bend	trans	-87.3	127.2	173.6	-166.7	-24	0	0	0	111.4	R857 L991 N996 Y997 R998	R857-D994 IonicContact CZ-OD1 3.57Å; R857-D994 IonicContact CZ-OD2 3.68Å; R857-D994 IonicContact NH1-OD1 3.73Å; R857-D994 PolarHBondContact NH1-OD1 2.97Å; R857-D994 VanDerWaalsContact NH1-OD1 3.11Å; R857-D994 IonicContact NH1-OD2 3.22Å; R857-D994 PolarHBondContact NH1-OD2 3.3Å; R857-D994 IonicContact NH2-OD1 2.85Å; R857-D994 PolarHBondContact NH2-OD1 3.47Å; R857-D994 IonicContact NH2-OD2 2.86Å; L991-D994 PolarHBondContact O-N 2.92Å; L991-D994 VanDerWaalsContact O-N 3.09Å; D994-N996 VanDerWaalsContact C-N 3.26Å; D994-N996 PolarHBondContact O-N 3.04Å; D994-N996 WeakPolarHBondContact OD1-CB 3.2Å; D994-N996 PolarHBondContact OD1-N 3.13Å; D994-N996 PolarHBondContact OD1-ND2 3.15Å; D994-Y997 HydrophobicContact CB-CD2 3.86Å; D994-Y997 PolarHBondContact O-N 3.11Å; D994-R998 PolarHBondContact O-N 2.84Å; D994-R998 VanDerWaalsContact O-N 3.09Å
995	E	92.7	Very high	92.8	Very high	32 Å²	32	37.4 Å²	37.4	15%	0.15	19%	0.189	C	C	.	.	H	α-helix	trans	-57.5	-35.2	174	177.3	157.6	-116.7	0	0	113.2	Y997 R998 N999 G1056 L1057 A1058 S1059	E995-Y997 VanDerWaalsContact C-N 3.29Å; E995-Y997 PolarHBondContact O-N 2.93Å; E995-R998 WeakPolarHBondContact O-CB 3.37Å; E995-R998 PolarHBondContact O-N 3.26Å; E995-R998 VanDerWaalsContact O-N 3.12Å; E995-N999 WeakPolarHBondContact CG-ND2 3.39Å; E995-N999 WeakPolarHBondContact O-CB 3.33Å; E995-N999 PolarHBondContact O-N 2.84Å; E995-G1056 WeakPolarHBondContact OE2-CA 3.39Å; E995-L1057 PolarHBondContact OE1-N 3.37Å; E995-A1058 PolarHBondContact OE1-N 2.7Å; E995-A1058 VanDerWaalsContact OE1-N 3.09Å; E995-S1059 VanDerWaalsContact OE1-CB 3.32Å; E995-S1059 WeakPolarHBondContact OE1-CB 3.14Å; E995-S1059 PolarHBondContact OE1-N 3.37Å; E995-S1059 PolarHBondContact OE1-OG 3.09Å
996	N	92.7	Very high	92.9	Very high	100 Å²	100	35.4 Å²	35.4	54%	0.535	18%	0.176	S	C	.	.	H	α-helix	trans	-62	-39.7	180	-70.2	-54.4	0	0	0	111.7	R857 D994 Y1000	R857-N996 PolarHBondContact NH1-ND2 3.41Å; D994-N996 VanDerWaalsContact C-N 3.26Å; D994-N996 PolarHBondContact O-N 3.04Å; D994-N996 WeakPolarHBondContact OD1-CB 3.2Å; D994-N996 PolarHBondContact OD1-N 3.13Å; D994-N996 PolarHBondContact OD1-ND2 3.15Å; N996-Y1000 VanDerWaalsContact O-CB 3.29Å; N996-Y1000 WeakPolarHBondContact O-CB 3.4Å; N996-Y1000 PolarHBondContact O-N 3Å
997	Y	95.7	Very high	92.3	Very high	24 Å²	24	37 Å²	37	9%	0.094	18%	0.184	C	C	.	.	H	α-helix	trans	-75.2	-31.6	175.4	-69.3	-50.5	0	0	0	112.2	S958 D961 Q962 L965 L991 D994 E995 L1001	S958-Y997 WeakPolarHBondContact CA-OH 3.42Å; S958-Y997 PolarHBondContact OG-OH 2.93Å; S958-Y997 VanDerWaalsContact OG-OH 3.12Å; D961-Y997 HydrophobicContact CB-CE1 4.05Å; Q962-Y997 HydrophobicContact CG-CE1 4.16Å; L965-Y997 HydrophobicContact CD1-CD1 3.6Å; L965-Y997 HydrophobicContact CD1-CE1 4.5Å; L965-Y997 HydrophobicContact CD1-CG 3.99Å; L991-Y997 HydrophobicContact CB-CD2 4.31Å; L991-Y997 HydrophobicContact CD2-CD2 4.01Å; L991-Y997 HydrophobicContact CD2-CE2 3.83Å; L991-Y997 WeakPolarHBondContact O-CB 3.11Å; L991-Y997 WeakPolarHBondContact O-CD2 3.3Å; D994-Y997 HydrophobicContact CB-CD2 3.86Å; D994-Y997 PolarHBondContact O-N 3.11Å; E995-Y997 VanDerWaalsContact C-N 3.29Å; E995-Y997 PolarHBondContact O-N 2.93Å; Y997-L1001 WeakPolarHBondContact O-CB 3.48Å; Y997-L1001 PolarHBondContact O-N 2.84Å
998	R	95.2	Very high	91.6	Very high	1 Å²	1	33.9 Å²	33.9	0%	0.004	18%	0.18	C	C	.	.	H	α-helix	trans	-61.7	-52.3	169.4	-67.7	-168.1	-69.4	-91.5	10.8	111.4	L992 S993 D994 E995 L1001 L1002 V1041 G1044 T1048 G1056 S1059	L992-R998 HydrophobicContact CB-CG 4.29Å; L992-R998 HydrophobicContact CD2-CG 4.11Å; L992-R998 WeakPolarHBondContact O-CD 3.25Å; L992-R998 VanDerWaalsContact O-CG 3.32Å; L992-R998 WeakPolarHBondContact O-CG 3.2Å; L992-R998 PolarHBondContact O-NH1 3.45Å; S993-R998 PolarHBondContact O-NH1 2.76Å; D994-R998 PolarHBondContact O-N 2.84Å; D994-R998 VanDerWaalsContact O-N 3.09Å; E995-R998 WeakPolarHBondContact O-CB 3.37Å; E995-R998 PolarHBondContact O-N 3.26Å; E995-R998 VanDerWaalsContact O-N 3.12Å; R998-L1001 PolarHBondContact O-N 2.86Å; R998-L1002 WeakPolarHBondContact O-CB 3.43Å; R998-L1002 VanDerWaalsContact O-CG 3.24Å; R998-L1002 WeakPolarHBondContact O-CG 3.4Å; R998-L1002 PolarHBondContact O-N 3.13Å; R998-V1041 HydrophobicContact CG-CG1 4.26Å; R998-G1044 PolarHBondContact NH1-O 2.97Å; R998-T1048 PolarHBondContact NH1-OG1 2.98Å; R998-T1048 PolarHBondContact NH2-OG1 2.78Å; R998-G1056 PolarHBondContact NH2-O 3.04Å; R998-S1059 PolarHBondContact NE-OG 3.33Å
999	N	93.1	Very high	90.9	Very high	18 Å²	18	35.2 Å²	35.2	10%	0.096	19%	0.187	C	C	.	.	H	α-helix	trans	-62.1	-45.6	179.7	-74.8	-18	0	0	0	111.6	E995 L1002 S1003 S1059 M1062	E995-N999 WeakPolarHBondContact CG-ND2 3.39Å; E995-N999 WeakPolarHBondContact O-CB 3.33Å; E995-N999 PolarHBondContact O-N 2.84Å; N999-L1002 PolarHBondContact O-N 2.83Å; N999-S1003 WeakPolarHBondContact O-CB 3.38Å; N999-S1003 PolarHBondContact O-N 3.14Å; N999-S1003 PolarHBondContact O-OG 3.21Å; N999-S1059 VanDerWaalsContact OD1-CA 3.29Å; N999-S1059 WeakPolarHBondContact OD1-CA 3.31Å; N999-S1059 WeakPolarHBondContact OD1-CB 3.46Å; N999-M1062 HydrophobicContact CB-SD 4.41Å; N999-M1062 PolarHBondContact OD1-SD 3.1Å; N999-M1062 VanDerWaalsContact OD1-SD 3.36Å
1000	Y	93.6	Very high	89.9	Confident	5 Å²	5	35.8 Å²	35.8	2%	0.02	20%	0.2	C	C	.	.	H	α-helix	trans	-57.9	-51.1	174	177.1	-92.4	0	0	0	111.4	Q962 L965 R966 N996 S1003 K1004	Q962-Y1000 HydrophobicContact CB-CE1 4.05Å; Q962-Y1000 HydrophobicContact CB-CE2 4.37Å; Q962-Y1000 HydrophobicContact CG-CD1 4.43Å; Q962-Y1000 HydrophobicContact CG-CD2 4.39Å; Q962-Y1000 HydrophobicContact CG-CE1 4.24Å; Q962-Y1000 HydrophobicContact CG-CE2 4.2Å; Q962-Y1000 HydrophobicContact CG-CG 4.5Å; Q962-Y1000 VanDerWaalsContact O-CE1 3.29Å; Q962-Y1000 WeakPolarHBondContact O-CE1 3.34Å; Q962-Y1000 PolarHBondContact O-OH 3.26Å; L965-Y1000 HydrophobicContact CB-CD1 4.21Å; L965-Y1000 HydrophobicContact CB-CE1 4.05Å; L965-Y1000 HydrophobicContact CD1-CD1 4.16Å; R966-Y1000 PolarHBondContact NH2-OH 3.18Å; R966-Y1000 VanDerWaalsContact NH2-OH 3.1Å; N996-Y1000 VanDerWaalsContact O-CB 3.29Å; N996-Y1000 WeakPolarHBondContact O-CB 3.4Å; N996-Y1000 PolarHBondContact O-N 3Å; Y1000-S1003 PolarHBondContact O-N 3.23Å; Y1000-S1003 PolarHBondContact O-OG 2.91Å; Y1000-K1004 WeakPolarHBondContact O-CG 3.24Å; Y1000-K1004 PolarHBondContact O-N 3.32Å
1001	L	95	Very high	89.4	Confident	1 Å²	1	32.7 Å²	32.7	1%	0.005	18%	0.184	C	C	.	.	H	α-helix	trans	-58.3	-52.3	178.7	178.4	76.6	0	0	0	112	L965 V969 L992 Y997 R998 S1003 K1004 L1005 L1037 V1041	L965-L1001 HydrophobicContact CB-CD1 4.36Å; L965-L1001 HydrophobicContact CD2-CD1 4.2Å; V969-L1001 HydrophobicContact CG2-CD1 3.51Å; L992-L1001 HydrophobicContact CD1-CD2 3.93Å; L992-L1001 HydrophobicContact CD2-CB 4.25Å; L992-L1001 HydrophobicContact CD2-CD2 3.56Å; L992-L1001 HydrophobicContact CG-CD2 4.38Å; Y997-L1001 WeakPolarHBondContact O-CB 3.48Å; Y997-L1001 PolarHBondContact O-N 2.84Å; R998-L1001 PolarHBondContact O-N 2.86Å; L1001-S1003 VanDerWaalsContact C-N 3.33Å; L1001-S1003 PolarHBondContact O-N 2.88Å; L1001-K1004 PolarHBondContact O-N 2.99Å; L1001-K1004 VanDerWaalsContact O-N 3.16Å; L1001-L1005 WeakPolarHBondContact O-CB 3.47Å; L1001-L1005 PolarHBondContact O-N 3.11Å; L1001-L1037 HydrophobicContact CD1-CD1 4.36Å; L1001-L1037 HydrophobicContact CD1-CD2 4.04Å; L1001-L1037 HydrophobicContact CD2-CD1 3.64Å; L1001-L1037 HydrophobicContact CD2-CD2 3.98Å; L1001-L1037 HydrophobicContact CD2-CG 3.93Å; L1001-L1037 HydrophobicContact CG-CD2 4.24Å; L1001-V1041 HydrophobicContact CD2-CG2 3.86Å
1002	L	94.2	Very high	88.8	Confident	2 Å²	2	33 Å²	33	1%	0.01	19%	0.188	C	C	.	.	H	α-helix	trans	-64.4	-37.2	-177.5	-68.5	168.1	0	0	0	111.7	R998 N999 K1004 L1005 N1006 V1041 S1059 M1062 L1063	R998-L1002 WeakPolarHBondContact O-CB 3.43Å; R998-L1002 VanDerWaalsContact O-CG 3.24Å; R998-L1002 WeakPolarHBondContact O-CG 3.4Å; R998-L1002 PolarHBondContact O-N 3.13Å; N999-L1002 PolarHBondContact O-N 2.83Å; L1002-K1004 PolarHBondContact O-N 3.45Å; L1002-L1005 PolarHBondContact O-N 3.1Å; L1002-N1006 PolarHBondContact O-N 3.44Å; L1002-V1041 HydrophobicContact CD1-CG1 4.31Å; L1002-S1059 WeakPolarHBondContact CD1-O 3.47Å; L1002-M1062 HydrophobicContact CB-CB 4.2Å; L1002-M1062 HydrophobicContact CB-CE 4.01Å; L1002-M1062 HydrophobicContact CD1-CB 3.99Å; L1002-L1063 HydrophobicContact CD1-CB 4.11Å; L1002-L1063 HydrophobicContact CD2-CB 4.43Å; L1002-L1063 HydrophobicContact CD2-CD1 4.38Å
1003	S	91	Very high	88.3	Confident	24 Å²	24	33 Å²	33	17%	0.168	19%	0.188	C	C	.	.	H	α-helix	trans	-63.6	-26.7	175.1	76.9	0	0	0	0	114	N999 Y1000 L1001	N999-S1003 WeakPolarHBondContact O-CB 3.38Å; N999-S1003 PolarHBondContact O-N 3.14Å; N999-S1003 PolarHBondContact O-OG 3.21Å; Y1000-S1003 PolarHBondContact O-N 3.23Å; Y1000-S1003 PolarHBondContact O-OG 2.91Å; L1001-S1003 VanDerWaalsContact C-N 3.33Å; L1001-S1003 PolarHBondContact O-N 2.88Å
1004	K	90.8	Very high	87.7	Confident	37 Å²	37	31 Å²	31	16%	0.161	17%	0.173	C	C	.	.	H	α-helix	trans	-89.4	-28.9	174.4	-59.8	-52.1	176.5	-165.4	0	112	V969 H973 Y1000 L1001 L1002	V969-K1004 HydrophobicContact CB-CB 4.49Å; V969-K1004 HydrophobicContact CG1-CB 4.07Å; V969-K1004 HydrophobicContact CG2-CB 4.22Å; H973-K1004 PolarHBondContact CE1-O 3.13Å; Y1000-K1004 WeakPolarHBondContact O-CG 3.24Å; Y1000-K1004 PolarHBondContact O-N 3.32Å; L1001-K1004 PolarHBondContact O-N 2.99Å; L1001-K1004 VanDerWaalsContact O-N 3.16Å; L1002-K1004 PolarHBondContact O-N 3.45Å
1005	L	90.7	Very high	87.2	Confident	1 Å²	1	30.8 Å²	30.8	1%	0.005	17%	0.171	C	C	.	.	H	α-helix	trans	-76.5	-48	-178.8	-167.6	66.6	0	0	0	112.3	V969 I972 H973 L1001 L1002 L1007 L1037 L1038 L1066	V969-L1005 HydrophobicContact CG1-CD1 4.35Å; I972-L1005 HydrophobicContact CG2-CD1 3.94Å; H973-L1005 PolarHBondContact NE2-O 3.22Å; L1001-L1005 WeakPolarHBondContact O-CB 3.47Å; L1001-L1005 PolarHBondContact O-N 3.11Å; L1002-L1005 PolarHBondContact O-N 3.1Å; L1005-L1007 PolarHBondContact O-N 2.82Å; L1005-L1037 HydrophobicContact CD1-CD2 4.25Å; L1005-L1037 HydrophobicContact CD2-CD2 3.78Å; L1005-L1038 HydrophobicContact CD2-CD2 4.49Å; L1005-L1066 HydrophobicContact CD2-CD2 3.67Å; L1005-L1066 HydrophobicContact CG-CD1 4.29Å; L1005-L1066 HydrophobicContact CG-CD2 4.3Å
1006	N	90.1	Very high	86.4	Confident	4 Å²	4	29.5 Å²	29.5	2%	0.021	17%	0.166	C	C	.	.			trans	-88.4	90.5	174.9	-177.1	-4	0	0	0	110.2	L1002 G1008 L1009 E1065 L1066 H1070	L1002-N1006 PolarHBondContact O-N 3.44Å; N1006-G1008 PolarHBondContact O-N 3.17Å; N1006-G1008 WeakPolarHBondContact OD1-CA 3.44Å; N1006-G1008 PolarHBondContact OD1-N 3.13Å; N1006-L1009 HydrophobicContact CB-CD1 3.74Å; N1006-L1009 HydrophobicContact CB-CG 3.91Å; N1006-L1009 WeakPolarHBondContact O-CB 3.33Å; N1006-L1009 PolarHBondContact O-N 2.97Å; N1006-E1065 PolarHBondContact ND2-OE1 2.94Å; N1006-E1065 VanDerWaalsContact ND2-OE1 3.13Å; N1006-L1066 HydrophobicContact CB-CD1 3.58Å; N1006-H1070 PolarHBondContact OD1-CE1 2.87Å
1007	L	80.4	Confident	85.6	Confident	116 Å²	116	27.7 Å²	27.7	61%	0.607	16%	0.156	S	C	*	.	G	3₁₀ helix	trans	-59.1	-27.4	177.5	-63.4	172.3	0	0	0	112.7	L1005 L1009 S1010	L1005-L1007 PolarHBondContact O-N 2.82Å; L1007-L1009 VanDerWaalsContact C-N 3.27Å; L1007-L1009 PolarHBondContact O-N 2.89Å; L1007-S1010 PolarHBondContact O-N 3.29Å; L1007-S1010 PolarHBondContact O-OG 3.4Å
1008	G	77.7	Confident	85	Confident	25 Å²	25	29.2 Å²	29.2	26%	0.258	16%	0.164	S	C	.	.	G	3₁₀ helix	trans	-67	-19.2	179.7	0	0	0	0	0	114.9	N1006 S1010 K1011 R1389	N1006-G1008 PolarHBondContact O-N 3.17Å; N1006-G1008 WeakPolarHBondContact OD1-CA 3.44Å; N1006-G1008 PolarHBondContact OD1-N 3.13Å; G1008-S1010 PolarHBondContact O-N 2.72Å; G1008-S1010 VanDerWaalsContact O-N 3.15Å; G1008-K1011 VanDerWaalsContact O-CB 3.31Å; G1008-K1011 WeakPolarHBondContact O-CB 3.48Å; G1008-K1011 PolarHBondContact O-N 2.94Å; G1008-R1389 PolarHBondContact O-NH2 3.4Å
1009	L	78.4	Confident	84.6	Confident	28 Å²	28	31 Å²	31	15%	0.147	18%	0.176	C	C	.	.	G	3₁₀ helix	trans	-57.5	-28.4	176.5	-75.7	164.8	0	0	0	113.3	N1006 L1007 K1011 M1062 R1389	N1006-L1009 HydrophobicContact CB-CD1 3.74Å; N1006-L1009 HydrophobicContact CB-CG 3.91Å; N1006-L1009 WeakPolarHBondContact O-CB 3.33Å; N1006-L1009 PolarHBondContact O-N 2.97Å; L1007-L1009 VanDerWaalsContact C-N 3.27Å; L1007-L1009 PolarHBondContact O-N 2.89Å; L1009-K1011 VanDerWaalsContact C-N 3.27Å; L1009-K1011 PolarHBondContact O-N 3.25Å; L1009-M1062 HydrophobicContact CD1-CE 3.45Å; L1009-M1062 VanDerWaalsContact CD1-CE 3.45Å; L1009-M1062 HydrophobicContact CD2-CE 4.44Å; L1009-R1389 PolarHBondContact O-NE 3.17Å
1010	S	73.1	Confident	84.5	Confident	80 Å²	80	30.7 Å²	30.7	56%	0.559	17%	0.174	S	C	*	.	G	3₁₀ helix	trans	-75	-12.5	178.5	63.6	0	0	0	0	114.2	L1007 G1008 S1012	L1007-S1010 PolarHBondContact O-N 3.29Å; L1007-S1010 PolarHBondContact O-OG 3.4Å; G1008-S1010 PolarHBondContact O-N 2.72Å; G1008-S1010 VanDerWaalsContact O-N 3.15Å; S1010-S1012 PolarHBondContact O-N 3.29Å
1011	K	82.1	Confident	84.2	Confident	75 Å²	75	33.5 Å²	33.5	33%	0.326	19%	0.193	S	C	.	.			trans	-72.3	120.8	177.1	-172.7	-173.6	173.6	-163.7	0	110.3	G1008 L1009 F1013 E1018 R1389	G1008-K1011 VanDerWaalsContact O-CB 3.31Å; G1008-K1011 WeakPolarHBondContact O-CB 3.48Å; G1008-K1011 PolarHBondContact O-N 2.94Å; L1009-K1011 VanDerWaalsContact C-N 3.27Å; L1009-K1011 PolarHBondContact O-N 3.25Å; K1011-F1013 HydrophobicContact CD-CE1 4.22Å; K1011-F1013 HydrophobicContact CD-CZ 4.03Å; K1011-F1013 HydrophobicContact CG-CE2 4.45Å; K1011-F1013 HydrophobicContact CG-CZ 4.45Å; K1011-F1013 WeakPolarHBondContact O-CE2 3.3Å; K1011-E1018 IonicContact NZ-OE1 2.78Å; K1011-E1018 PolarHBondContact NZ-OE1 3.34Å; K1011-R1389 PolarHBondContact O-NE 2.89Å
1012	S	80.9	Confident	83.8	Confident	24 Å²	24	35.5 Å²	35.5	17%	0.168	20%	0.204	C	C	.	.			trans	-82.1	151.8	163.7	61.8	0	0	0	0	111.4	S842 S1010 R1389 K1391	S842-S1012 WeakPolarHBondContact OG-CB 3.23Å; S1010-S1012 PolarHBondContact O-N 3.29Å; S1012-R1389 CarbonylContact C-O 3.6Å; S1012-R1389 WeakPolarHBondContact CA-O 3.3Å; S1012-K1391 WeakPolarHBondContact OG-CE 3.46Å; S1012-K1391 PolarHBondContact OG-NZ 2.85Å
1013	F	84.6	Confident	83.6	Confident	0 Å²	0	37.5 Å²	37.5	0%	0	22%	0.216	C	C	.	.	B	Isolated β-bridge	trans	-114.3	130.7	178.1	-63.7	-99.5	0	0	0	110.1	K1011 E1018 I1020 P1385 R1389 L1390 K1391	K1011-F1013 HydrophobicContact CD-CE1 4.22Å; K1011-F1013 HydrophobicContact CD-CZ 4.03Å; K1011-F1013 HydrophobicContact CG-CE2 4.45Å; K1011-F1013 HydrophobicContact CG-CZ 4.45Å; K1011-F1013 WeakPolarHBondContact O-CE2 3.3Å; F1013-E1018 HydrophobicContact CD1-CB 4.03Å; F1013-E1018 HydrophobicContact CD1-CG 3.82Å; F1013-E1018 HydrophobicContact CE1-CG 4.16Å; F1013-I1020 HydrophobicContact CE2-CG1 4.49Å; F1013-I1020 HydrophobicContact CZ-CB 4.45Å; F1013-I1020 HydrophobicContact CZ-CG1 4.02Å; F1013-P1385 HydrophobicContact CB-CB 4.18Å; F1013-P1385 HydrophobicContact CB-CG 4.16Å; F1013-P1385 HydrophobicContact CD1-CB 4.28Å; F1013-P1385 HydrophobicContact CD1-CG 4.39Å; F1013-P1385 HydrophobicContact CD2-CB 3.48Å; F1013-P1385 VanDerWaalsContact CD2-CB 3.48Å; F1013-P1385 HydrophobicContact CD2-CG 4.31Å; F1013-P1385 HydrophobicContact CE2-CB 3.87Å; F1013-P1385 HydrophobicContact CG-CB 3.72Å; F1013-P1385 HydrophobicContact CG-CG 4.04Å; F1013-P1385 HydrophobicContact CZ-CB 4.41Å; F1013-R1389 HydrophobicContact CD2-CB 4.2Å; F1013-R1389 PolarHBondContact N-O 3.28Å; F1013-L1390 HydrophobicContact CB-CD1 4.27Å; F1013-K1391 PolarHBondContact O-N 3.28Å
1014	D	79.9	Confident	83.5	Confident	19 Å²	19	40 Å²	40	10%	0.102	23%	0.232	C	C	.	.	S	Bend	trans	-109.9	5	-174.8	-60.1	-61.1	0	0	0	112.6	K1391 Y1414 K1416	D1014-K1391 WeakPolarHBondContact OD1-CD 3.14Å; D1014-Y1414 VanDerWaalsContact O-CB 3.28Å; D1014-Y1414 WeakPolarHBondContact O-CB 3.12Å; D1014-K1416 HydrophobicContact CB-CB 4.08Å; D1014-K1416 HydrophobicContact CB-CD 3.88Å; D1014-K1416 HydrophobicContact CB-CG 3.66Å; D1014-K1416 PolarHBondContact O-N 3.08Å; D1014-K1416 VanDerWaalsContact O-N 3.1Å
1015	D	79.4	Confident	83.3	Confident	30 Å²	30	39 Å²	39	16%	0.16	23%	0.228	C	C	.	.	S	Bend	trans	-133.4	125.7	172.3	178.7	-10.2	0	0	0	108.1	D1017 E1018 K1430	D1015-D1017 PolarHBondContact O-N 2.97Å; D1015-D1017 PolarHBondContact OD1-N 3.29Å; D1015-E1018 HydrophobicContact CB-CB 4.15Å; D1015-E1018 PolarHBondContact O-N 3.31Å; D1015-K1430 IonicContact OD1-NZ 2.78Å; D1015-K1430 PolarHBondContact OD1-NZ 3.13Å; D1015-K1430 IonicContact OD2-NZ 2.66Å; D1015-K1430 PolarHBondContact OD2-NZ 3.36Å
1016	P	75.4	Confident	82.9	Confident	6 Å²	6	45 Å²	45	4%	0.039	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-17	177.6	28.3	-36.7	0	0	0	115.1	L1390 Y1414	P1016-L1390 HydrophobicContact CB-CD1 4.41Å; P1016-L1390 HydrophobicContact CB-CD2 4.49Å; P1016-Y1414 HydrophobicContact CB-CE1 3.88Å; P1016-Y1414 HydrophobicContact CG-CD1 4.49Å; P1016-Y1414 HydrophobicContact CG-CE1 3.93Å; P1016-Y1414 HydrophobicContact CG-CE2 3.99Å
1017	D	77.3	Confident	82.6	Confident	62 Å²	62	47.1 Å²	47.1	33%	0.332	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.4	3.7	178.7	-53.2	-34.2	0	0	0	112.8	D1015 Q1207 K1430	D1015-D1017 PolarHBondContact O-N 2.97Å; D1015-D1017 PolarHBondContact OD1-N 3.29Å; D1017-Q1207 PolarHBondContact O-NE2 3.11Å; D1017-K1430 WeakPolarHBondContact OD2-CD 3.35Å; D1017-K1430 IonicContact OD2-NZ 2.62Å; D1017-K1430 PolarHBondContact OD2-NZ 3.45Å
1018	E	82.7	Confident	82.9	Confident	56 Å²	56	43 Å²	43	26%	0.262	25%	0.249	S	C	.	.			trans	-86.1	111.7	178.8	-170.8	-175.5	179.3	0	0	111.5	K1011 F1013 D1015 P1385	K1011-E1018 IonicContact NZ-OE1 2.78Å; K1011-E1018 PolarHBondContact NZ-OE1 3.34Å; F1013-E1018 HydrophobicContact CD1-CB 4.03Å; F1013-E1018 HydrophobicContact CD1-CG 3.82Å; F1013-E1018 HydrophobicContact CE1-CG 4.16Å; D1015-E1018 HydrophobicContact CB-CB 4.15Å; D1015-E1018 PolarHBondContact O-N 3.31Å; E1018-P1385 VanDerWaalsContact O-CD 3.29Å; E1018-P1385 WeakPolarHBondContact O-CD 3.47Å
1019	C	87	Confident	83.3	Confident	37 Å²	37	45.2 Å²	45.2	25%	0.25	25%	0.254	C	S	.	.	P	Polyproline II helix	trans	-75.2	160.3	176.8	-53.2	0	0	0	0	113.2	D1382 L1383	C1019-D1382 HydrophobicContact CB-CB 3.79Å; C1019-L1383 CarbonylContact C-O 3.53Å; C1019-L1383 VanDerWaalsContact CA-O 3.28Å; C1019-L1383 WeakPolarHBondContact CA-O 3.27Å; C1019-L1383 WeakPolarHBondContact CB-O 3.43Å
1020	I	89.3	Confident	83.7	Confident	12 Å²	12	43.9 Å²	43.9	6%	0.062	25%	0.248	C	C	.	.	P	Polyproline II helix	trans	-67.6	125.7	175.9	-57.3	167.6	0	0	0	109.8	F1013 E1065 T1069 L1383	F1013-I1020 HydrophobicContact CE2-CG1 4.49Å; F1013-I1020 HydrophobicContact CZ-CB 4.45Å; F1013-I1020 HydrophobicContact CZ-CG1 4.02Å; I1020-E1065 HydrophobicContact CD1-CG 4.26Å; I1020-T1069 HydrophobicContact CG2-CG2 3.84Å; I1020-L1383 HydrophobicContact CB-CB 4.25Å; I1020-L1383 HydrophobicContact CD1-CB 3.88Å; I1020-L1383 HydrophobicContact CD1-CD1 4.42Å; I1020-L1383 HydrophobicContact CG1-CB 4.33Å; I1020-L1383 PolarHBondContact N-O 2.62Å
1021	P	87.7	Confident	84.5	Confident	64 Å²	64	40.2 Å²	40.2	42%	0.416	22%	0.222	S	C	.	.	P	Polyproline II helix	trans	-78.7	152.7	-175.1	31.4	-36.2	0	0	0	113.9
1022	D	88.1	Confident	84.8	Confident	44 Å²	44	39 Å²	39	24%	0.235	22%	0.216	C	C	.	.	P	Polyproline II helix	trans	-66.5	143.6	170.8	-60	-36.6	0	0	0	111.4	T1069 Y1071 K1205 R1254 Y1256	D1022-T1069 CarbonylContact C-O 3.53Å; D1022-T1069 WeakPolarHBondContact CA-O 3.42Å; D1022-Y1071 HydrophobicContact CB-CD1 3.92Å; D1022-Y1071 HydrophobicContact CB-CE1 3.67Å; D1022-K1205 IonicContact OD1-NZ 2.81Å; D1022-K1205 PolarHBondContact OD1-NZ 3.29Å; D1022-K1205 IonicContact OD2-NZ 2.86Å; D1022-K1205 PolarHBondContact OD2-NZ 3.46Å; D1022-R1254 IonicContact OD2-NH1 3.32Å; D1022-R1254 PolarHBondContact OD2-NH1 2.83Å; D1022-Y1256 PolarHBondContact OD2-OH 2.79Å
1023	V	88.2	Confident	85.3	Confident	43 Å²	43	38.2 Å²	38.2	26%	0.261	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	123.9	-177.6	-177.3	0	0	0	0	111.2	T1069 H1070 Y1071	V1023-T1069 PolarHBondContact N-O 2.87Å; V1023-H1070 VanDerWaalsContact O-CA 3.3Å; V1023-H1070 WeakPolarHBondContact O-CA 3.32Å; V1023-Y1071 WeakPolarHBondContact O-CD1 3.48Å; V1023-Y1071 PolarHBondContact O-N 3.25Å
1024	P	88.7	Confident	85.6	Confident	78 Å²	78	38.5 Å²	38.5	51%	0.506	21%	0.212	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	134.2	178.1	30.1	-33.6	0	0	0	112.5	Y1071	P1024-Y1071 CarbonylContact C-O 3.48Å; P1024-Y1071 WeakPolarHBondContact CA-O 3.45Å; P1024-Y1071 HydrophobicContact CB-CE1 4.26Å; P1024-Y1071 HydrophobicContact CB-CE2 4.25Å
1025	I	87.5	Confident	86.1	Confident	14 Å²	14	38.3 Å²	38.3	7%	0.072	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	131.5	170	-57.8	177	0	0	0	109.2	N1027 Y1031 H1070 Y1071 L1257	I1025-N1027 PolarHBondContact O-N 2.94Å; I1025-Y1031 HydrophobicContact CD1-CD2 4.07Å; I1025-H1070 HydrophobicContact CD1-CB 4.06Å; I1025-H1070 HydrophobicContact CG1-CB 4.14Å; I1025-Y1071 PolarHBondContact N-O 3.32Å; I1025-L1257 HydrophobicContact CD1-CD1 3.93Å; I1025-L1257 HydrophobicContact CD1-CD2 3.67Å; I1025-L1257 HydrophobicContact CD1-CG 3.79Å
1026	I	81.7	Confident	86.7	Confident	127 Å²	127	37.7 Å²	37.7	65%	0.651	21%	0.206	S	C	*	.	S	Bend	trans	-56.6	-45	-169.3	-66.2	156.2	0	0	0	113.8	H973	H973-I1026 WeakPolarHBondContact O-CD1 3.29Å
1027	N	84.7	Confident	87.5	Confident	49 Å²	49	37.4 Å²	37.4	26%	0.262	20%	0.204	S	C	.	.			trans	-154.6	171.7	-176.9	74	28.9	0	0	0	113.6	G975 I1025 N1029 G1030 Y1031	G975-N1027 PolarHBondContact O-ND2 3.31Å; G975-N1027 VanDerWaalsContact O-ND2 3.1Å; G975-N1027 PolarHBondContact O-OD1 3.41Å; I1025-N1027 PolarHBondContact O-N 2.94Å; N1027-N1029 VanDerWaalsContact C-N 3.31Å; N1027-N1029 PolarHBondContact O-N 3.28Å; N1027-N1029 WeakPolarHBondContact OD1-CA 3.27Å; N1027-N1029 WeakPolarHBondContact OD1-CB 3.47Å; N1027-N1029 PolarHBondContact OD1-N 3.47Å; N1027-G1030 PolarHBondContact O-N 2.94Å; N1027-G1030 PolarHBondContact OD1-N 2.81Å; N1027-Y1031 PolarHBondContact O-N 3.03Å
1028	M	86.4	Confident	88.3	Confident	31 Å²	31	34.4 Å²	34.4	15%	0.153	19%	0.188	C	C	.	.	H	α-helix	trans	-58.4	-35.1	179.4	-172.9	61.9	67.1	0	0	114.1	Y1031 K1032 L1072 M1074 F1104 W1107	M1028-Y1031 PolarHBondContact O-N 2.86Å; M1028-K1032 WeakPolarHBondContact O-CG 3.47Å; M1028-K1032 PolarHBondContact O-N 3.37Å; M1028-L1072 HydrophobicContact CE-CD2 3.44Å; M1028-L1072 VanDerWaalsContact CE-CD2 3.44Å; M1028-L1072 HydrophobicContact SD-CD2 3.71Å; M1028-M1074 HydrophobicContact CE-CE 4.04Å; M1028-F1104 HydrophobicContact CE-CE1 4.49Å; M1028-F1104 HydrophobicContact CE-CE2 3.66Å; M1028-F1104 HydrophobicContact CE-CZ 3.36Å; M1028-F1104 HydrophobicContact SD-CE2 4.5Å; M1028-F1104 HydrophobicContact SD-CZ 3.93Å; M1028-W1107 HydrophobicContact SD-CZ3 4.48Å
1029	N	86.8	Confident	88.7	Confident	70 Å²	70	34.9 Å²	34.9	37%	0.374	19%	0.19	S	C	.	.	H	α-helix	trans	-72.9	-41.7	-179.5	-67	-28.5	0	0	0	110.9	G975 N1027 K1032 S1033	G975-N1029 WeakPolarHBondContact O-CB 3.38Å; N1027-N1029 VanDerWaalsContact C-N 3.31Å; N1027-N1029 PolarHBondContact O-N 3.28Å; N1027-N1029 WeakPolarHBondContact OD1-CA 3.27Å; N1027-N1029 WeakPolarHBondContact OD1-CB 3.47Å; N1027-N1029 PolarHBondContact OD1-N 3.47Å; N1029-K1032 PolarHBondContact O-N 2.9Å; N1029-S1033 WeakPolarHBondContact O-CB 3.4Å; N1029-S1033 PolarHBondContact O-N 3.41Å; N1029-S1033 PolarHBondContact O-OG 3.4Å
1030	G	86.7	Confident	89.1	Confident	1 Å²	1	33.3 Å²	33.3	1%	0.01	18%	0.18	C	C	.	.	H	α-helix	trans	-57.4	-48.6	169.4	0	0	0	0	0	110.8	N1027 K1032 S1033 H1034	N1027-G1030 PolarHBondContact O-N 2.94Å; N1027-G1030 PolarHBondContact OD1-N 2.81Å; G1030-K1032 PolarHBondContact O-N 2.94Å; G1030-S1033 PolarHBondContact O-N 3.02Å; G1030-S1033 VanDerWaalsContact O-N 3.17Å; G1030-H1034 PolarHBondContact O-N 2.82Å; G1030-H1034 PolarHBondContact O-ND1 2.82Å
1031	Y	89.5	Confident	89.3	Confident	3 Å²	3	32.7 Å²	32.7	1%	0.012	18%	0.177	C	C	.	.	H	α-helix	trans	-55.1	-52.8	176.5	179.7	-89.8	0	0	0	112.4	I1025 N1027 M1028 S1033 H1034 I1035 L1072 V1255 Y1256 L1257 N1260	I1025-Y1031 HydrophobicContact CD1-CD2 4.07Å; N1027-Y1031 PolarHBondContact O-N 3.03Å; M1028-Y1031 PolarHBondContact O-N 2.86Å; Y1031-S1033 VanDerWaalsContact C-N 3.27Å; Y1031-S1033 PolarHBondContact O-N 3.32Å; Y1031-H1034 WeakPolarHBondContact O-CB 3.32Å; Y1031-H1034 PolarHBondContact O-N 3.43Å; Y1031-I1035 HydrophobicContact CD1-CG1 4.49Å; Y1031-I1035 HydrophobicContact CE1-CG1 4.06Å; Y1031-I1035 PolarHBondContact O-N 3.04Å; Y1031-I1035 VanDerWaalsContact O-N 3.14Å; Y1031-L1072 HydrophobicContact CD2-CB 3.66Å; Y1031-L1072 HydrophobicContact CD2-CD2 4.42Å; Y1031-L1072 HydrophobicContact CE2-CB 4.27Å; Y1031-L1072 HydrophobicContact CG-CB 4.17Å; Y1031-L1072 HydrophobicContact CG-CD2 4.11Å; Y1031-V1255 HydrophobicContact CE2-CG1 4.37Å; Y1031-Y1256 PolarHBondContact OH-O 3.01Å; Y1031-L1257 HydrophobicContact CD2-CD2 3.78Å; Y1031-L1257 HydrophobicContact CE2-CD2 3.71Å; Y1031-L1257 HydrophobicContact CE2-CG 4.42Å; Y1031-N1260 PolarHBondContact OH-ND2 3.5Å
1032	K	89	Confident	89.7	Confident	50 Å²	50	30.2 Å²	30.2	22%	0.217	16%	0.16	C	C	.	.	H	α-helix	trans	-61	-36.7	177.7	-69	-175.1	-174.4	-162.5	0	112.4	M1028 N1029 G1030 I1035 W1036 T1111	M1028-K1032 WeakPolarHBondContact O-CG 3.47Å; M1028-K1032 PolarHBondContact O-N 3.37Å; N1029-K1032 PolarHBondContact O-N 2.9Å; G1030-K1032 PolarHBondContact O-N 2.94Å; K1032-I1035 PolarHBondContact O-N 2.9Å; K1032-W1036 PolarHBondContact O-N 2.89Å; K1032-W1036 VanDerWaalsContact O-N 3.11Å; K1032-T1111 PolarHBondContact NZ-OG1 2.62Å
1033	S	90.7	Very high	89.9	Confident	6 Å²	6	30.5 Å²	30.5	4%	0.042	16%	0.16	C	C	.	.	H	α-helix	trans	-73.3	-31.4	179.4	-52.8	0	0	0	0	112.9	V979 N1029 G1030 Y1031 L1037	V979-S1033 WeakPolarHBondContact CG2-OG 3.45Å; N1029-S1033 WeakPolarHBondContact O-CB 3.4Å; N1029-S1033 PolarHBondContact O-N 3.41Å; N1029-S1033 PolarHBondContact O-OG 3.4Å; G1030-S1033 PolarHBondContact O-N 3.02Å; G1030-S1033 VanDerWaalsContact O-N 3.17Å; Y1031-S1033 VanDerWaalsContact C-N 3.27Å; Y1031-S1033 PolarHBondContact O-N 3.32Å; S1033-L1037 WeakPolarHBondContact O-CB 3.47Å; S1033-L1037 PolarHBondContact O-N 3.09Å; S1033-L1037 VanDerWaalsContact O-N 3.11Å
1034	H	91.3	Very high	90.2	Very high	6 Å²	6	28.4 Å²	28.4	3%	0.028	15%	0.147	C	C	.	.	H	α-helix	trans	-60.9	-55.6	167.5	-76.4	80.7	0	0	0	109.9	I972 G1030 Y1031 W1036 L1037 L1038 L1257	I972-H1034 WeakPolarHBondContact CG2-CE1 3.34Å; I972-H1034 VanDerWaalsContact CG2-ND1 3.31Å; I972-H1034 WeakPolarHBondContact CG2-ND1 3.21Å; G1030-H1034 PolarHBondContact O-N 2.82Å; G1030-H1034 PolarHBondContact O-ND1 2.82Å; Y1031-H1034 WeakPolarHBondContact O-CB 3.32Å; Y1031-H1034 PolarHBondContact O-N 3.43Å; H1034-W1036 VanDerWaalsContact C-N 3.29Å; H1034-W1036 PolarHBondContact O-N 3.2Å; H1034-L1037 WeakPolarHBondContact O-CA 3.34Å; H1034-L1037 WeakPolarHBondContact O-CB 3.37Å; H1034-L1037 PolarHBondContact O-N 2.69Å; H1034-L1038 VanDerWaalsContact O-CG 3.27Å; H1034-L1038 WeakPolarHBondContact O-CG 3.26Å; H1034-L1038 PolarHBondContact O-N 3.34Å; H1034-L1257 HydrophobicContact CB-CD1 4.11Å; H1034-L1257 HydrophobicContact CB-CD2 3.65Å
1035	I	90	Very high	90.4	Very high	16 Å²	16	24.7 Å²	24.7	8%	0.082	12%	0.123	C	C	.	.	H	α-helix	trans	-52.9	-46.1	-179.2	-62	-61	0	0	0	112	Y1031 K1032 L1037 L1038 Q1039 L1257 N1260 L1261	Y1031-I1035 HydrophobicContact CD1-CG1 4.49Å; Y1031-I1035 HydrophobicContact CE1-CG1 4.06Å; Y1031-I1035 PolarHBondContact O-N 3.04Å; Y1031-I1035 VanDerWaalsContact O-N 3.14Å; K1032-I1035 PolarHBondContact O-N 2.9Å; I1035-L1037 PolarHBondContact O-N 2.93Å; I1035-L1038 PolarHBondContact O-N 3.25Å; I1035-Q1039 WeakPolarHBondContact O-CG 3.17Å; I1035-Q1039 PolarHBondContact O-N 3.44Å; I1035-L1257 HydrophobicContact CD1-CB 4.12Å; I1035-L1257 HydrophobicContact CD1-CD2 3.65Å; I1035-L1257 WeakPolarHBondContact CD1-O 2.93Å; I1035-L1257 HydrophobicContact CG1-CD2 4.08Å; I1035-N1260 HydrophobicContact CD1-CB 3.84Å; I1035-N1260 HydrophobicContact CG1-CB 4.19Å; I1035-N1260 HydrophobicContact CG2-CB 4.37Å; I1035-L1261 HydrophobicContact CG2-CD2 4.49Å
1036	W	91.3	Very high	90.7	Very high	16 Å²	16	25.9 Å²	25.9	6%	0.061	13%	0.128	C	C	.	.	H	α-helix	trans	-58.6	-43.8	175.4	167.9	80.5	0	0	0	113.2	V968 V979 Q980 F983 V985 L988 K1032 H1034 C1040	V968-W1036 HydrophobicContact CG1-CZ3 4.39Å; V979-W1036 HydrophobicContact CG1-CE3 4.43Å; V979-W1036 HydrophobicContact CG1-CZ3 3.93Å; Q980-W1036 HydrophobicContact CB-CD2 3.99Å; Q980-W1036 HydrophobicContact CB-CG 4.06Å; Q980-W1036 HydrophobicContact CB-CZ2 4.25Å; F983-W1036 HydrophobicContact CB-CH2 4.13Å; V985-W1036 HydrophobicContact CG2-CZ2 3.87Å; L988-W1036 HydrophobicContact CD2-CH2 3.44Å; L988-W1036 VanDerWaalsContact CD2-CH2 3.44Å; L988-W1036 HydrophobicContact CD2-CZ2 3.86Å; L988-W1036 HydrophobicContact CD2-CZ3 3.91Å; K1032-W1036 PolarHBondContact O-N 2.89Å; K1032-W1036 VanDerWaalsContact O-N 3.11Å; H1034-W1036 VanDerWaalsContact C-N 3.29Å; H1034-W1036 PolarHBondContact O-N 3.2Å; W1036-C1040 PolarHBondContact O-N 3.02Å; W1036-C1040 PolarHBondContact O-SG 2.85Å; W1036-C1040 VanDerWaalsContact O-SG 3.38Å
1037	L	93.3	Very high	91.1	Very high	0 Å²	0	22.8 Å²	22.8	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-66.6	-43	177.9	-177.6	60.3	0	0	0	111.4	V968 I972 L988 L992 L1001 L1005 S1033 H1034 I1035 Q1039 C1040 V1041	V968-L1037 HydrophobicContact CG1-CD1 4.2Å; V968-L1037 HydrophobicContact CG1-CD2 4.45Å; I972-L1037 HydrophobicContact CD1-CB 4.04Å; I972-L1037 HydrophobicContact CD1-CD2 3.4Å; I972-L1037 VanDerWaalsContact CD1-CD2 3.4Å; I972-L1037 HydrophobicContact CD1-CG 4.26Å; L988-L1037 HydrophobicContact CD1-CD1 4.21Å; L988-L1037 HydrophobicContact CD2-CD1 3.75Å; L988-L1037 HydrophobicContact CG-CD1 4.38Å; L992-L1037 HydrophobicContact CD1-CD1 4.44Å; L1001-L1037 HydrophobicContact CD1-CD1 4.36Å; L1001-L1037 HydrophobicContact CD1-CD2 4.04Å; L1001-L1037 HydrophobicContact CD2-CD1 3.64Å; L1001-L1037 HydrophobicContact CD2-CD2 3.98Å; L1001-L1037 HydrophobicContact CD2-CG 3.93Å; L1001-L1037 HydrophobicContact CG-CD2 4.24Å; L1005-L1037 HydrophobicContact CD1-CD2 4.25Å; L1005-L1037 HydrophobicContact CD2-CD2 3.78Å; S1033-L1037 WeakPolarHBondContact O-CB 3.47Å; S1033-L1037 PolarHBondContact O-N 3.09Å; S1033-L1037 VanDerWaalsContact O-N 3.11Å; H1034-L1037 WeakPolarHBondContact O-CA 3.34Å; H1034-L1037 WeakPolarHBondContact O-CB 3.37Å; H1034-L1037 PolarHBondContact O-N 2.69Å; I1035-L1037 PolarHBondContact O-N 2.93Å; L1037-Q1039 PolarHBondContact O-N 3.07Å; L1037-C1040 WeakPolarHBondContact O-CA 3.27Å; L1037-C1040 WeakPolarHBondContact O-CB 3.11Å; L1037-C1040 PolarHBondContact O-N 3.36Å; L1037-V1041 PolarHBondContact O-N 3.03Å
1038	L	92.9	Very high	91.4	Very high	0 Å²	0	21.3 Å²	21.3	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-63.9	-38.9	178.3	-59.7	173.3	0	0	0	111.7	L1005 H1034 I1035 C1040 V1041 I1042 L1063 L1066 L1257 L1261	L1005-L1038 HydrophobicContact CD2-CD2 4.49Å; H1034-L1038 VanDerWaalsContact O-CG 3.27Å; H1034-L1038 WeakPolarHBondContact O-CG 3.26Å; H1034-L1038 PolarHBondContact O-N 3.34Å; I1035-L1038 PolarHBondContact O-N 3.25Å; L1038-C1040 PolarHBondContact O-N 3.02Å; L1038-V1041 PolarHBondContact O-N 2.84Å; L1038-V1041 VanDerWaalsContact O-N 3.1Å; L1038-I1042 VanDerWaalsContact O-CG1 3.27Å; L1038-I1042 WeakPolarHBondContact O-CG1 3.21Å; L1038-I1042 PolarHBondContact O-N 2.83Å; L1038-L1063 HydrophobicContact CB-CD1 4.16Å; L1038-L1063 HydrophobicContact CD2-CD1 3.3Å; L1038-L1063 HydrophobicContact CG-CD1 4.22Å; L1038-L1066 HydrophobicContact CD1-CD2 4.15Å; L1038-L1066 HydrophobicContact CD2-CD2 3.42Å; L1038-L1066 VanDerWaalsContact CD2-CD2 3.42Å; L1038-L1066 HydrophobicContact CG-CD2 4.3Å; L1038-L1257 HydrophobicContact CD1-CB 4.29Å; L1038-L1257 HydrophobicContact CD1-CD1 3.99Å; L1038-L1261 HydrophobicContact CB-CD1 4.49Å; L1038-L1261 HydrophobicContact CD1-CD1 4.31Å
1039	Q	92.2	Very high	91.4	Very high	65 Å²	65	20.9 Å²	20.9	30%	0.304	10%	0.104	S	C	.	.	H	α-helix	trans	-59.8	-31.6	171.2	-73.2	-179.7	-11.5	0	0	112.5	I1035 L1037 H1043 L1261 E1266	I1035-Q1039 WeakPolarHBondContact O-CG 3.17Å; I1035-Q1039 PolarHBondContact O-N 3.44Å; L1037-Q1039 PolarHBondContact O-N 3.07Å; Q1039-H1043 PolarHBondContact O-N 3.33Å; Q1039-L1261 HydrophobicContact CG-CD2 4.18Å; Q1039-E1266 PolarHBondContact NE2-OE2 3.03Å; Q1039-E1266 VanDerWaalsContact NE2-OE2 3.08Å
1040	C	94.1	Very high	91.3	Very high	4 Å²	4	19.5 Å²	19.5	3%	0.027	10%	0.098	C	C	.	.	H	α-helix	trans	-74.8	-35.4	172.9	-62.3	0	0	0	0	112.8	L988 K989 L992 W1036 L1037 L1038 G1044	L988-C1040 HydrophobicContact CD2-CB 4.03Å; L988-C1040 HydrophobicContact CG-CB 4.22Å; K989-C1040 HydrophobicContact CG-CB 4.27Å; L992-C1040 HydrophobicContact CD1-CB 3.93Å; W1036-C1040 PolarHBondContact O-N 3.02Å; W1036-C1040 PolarHBondContact O-SG 2.85Å; W1036-C1040 VanDerWaalsContact O-SG 3.38Å; L1037-C1040 WeakPolarHBondContact O-CA 3.27Å; L1037-C1040 WeakPolarHBondContact O-CB 3.11Å; L1037-C1040 PolarHBondContact O-N 3.36Å; L1038-C1040 PolarHBondContact O-N 3.02Å; C1040-G1044 PolarHBondContact O-N 3.12Å
1041	V	95.1	Very high	91.1	Very high	0 Å²	0	23.3 Å²	23.3	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-66.1	-44.2	172.9	-179.4	0	0	0	0	111.1	L992 R998 L1001 L1002 L1037 L1038 H1043 G1044 L1045 L1063	L992-V1041 HydrophobicContact CD1-CG2 3.89Å; R998-V1041 HydrophobicContact CG-CG1 4.26Å; L1001-V1041 HydrophobicContact CD2-CG2 3.86Å; L1002-V1041 HydrophobicContact CD1-CG1 4.31Å; L1037-V1041 PolarHBondContact O-N 3.03Å; L1038-V1041 PolarHBondContact O-N 2.84Å; L1038-V1041 VanDerWaalsContact O-N 3.1Å; V1041-H1043 VanDerWaalsContact C-N 3.33Å; V1041-H1043 PolarHBondContact O-N 2.65Å; V1041-G1044 WeakPolarHBondContact O-CA 3.2Å; V1041-G1044 PolarHBondContact O-N 3.09Å; V1041-L1045 PolarHBondContact O-N 3.15Å; V1041-L1063 HydrophobicContact CB-CD1 4.23Å; V1041-L1063 HydrophobicContact CG1-CD1 4.06Å; V1041-L1063 HydrophobicContact CG1-CD2 4.12Å; V1041-L1063 HydrophobicContact CG1-CG 4.48Å
1042	I	94.7	Very high	90.4	Very high	12 Å²	12	26.6 Å²	26.6	6%	0.062	13%	0.133	C	C	.	.	H	α-helix	trans	-59.4	-43	177	-67.6	163.2	0	0	0	110.8	L1038 G1044 L1045 E1046 L1063 L1261 W1271	L1038-I1042 VanDerWaalsContact O-CG1 3.27Å; L1038-I1042 WeakPolarHBondContact O-CG1 3.21Å; L1038-I1042 PolarHBondContact O-N 2.83Å; I1042-G1044 PolarHBondContact O-N 2.83Å; I1042-L1045 WeakPolarHBondContact O-CB 3.37Å; I1042-L1045 PolarHBondContact O-N 3.19Å; I1042-L1045 VanDerWaalsContact O-N 3.08Å; I1042-E1046 HydrophobicContact CG2-CG 4.47Å; I1042-E1046 WeakPolarHBondContact O-CG 3.28Å; I1042-E1046 PolarHBondContact O-N 2.91Å; I1042-L1063 HydrophobicContact CG1-CD2 3.86Å; I1042-L1261 HydrophobicContact CD1-CD1 4.21Å; I1042-L1261 HydrophobicContact CD1-CD2 3.97Å; I1042-W1271 HydrophobicContact CD1-CZ2 3.9Å; I1042-W1271 HydrophobicContact CG1-CH2 4.23Å; I1042-W1271 HydrophobicContact CG1-CZ2 3.88Å; I1042-W1271 HydrophobicContact CG2-CZ2 4.21Å
1043	H	93.3	Very high	89.6	Confident	49 Å²	49	25.9 Å²	25.9	23%	0.227	14%	0.14	C	C	.	.	H	α-helix	trans	-59.2	-35.6	172.9	-179.1	-86.3	0	0	0	112.3	K989 Q1039 V1041 Q1047	K989-H1043 HydrophobicContact CD-CB 4.49Å; K989-H1043 HydrophobicContact CG-CB 4.46Å; Q1039-H1043 PolarHBondContact O-N 3.33Å; V1041-H1043 VanDerWaalsContact C-N 3.33Å; V1041-H1043 PolarHBondContact O-N 2.65Å; H1043-Q1047 VanDerWaalsContact O-CG 3.25Å; H1043-Q1047 WeakPolarHBondContact O-CG 3.47Å; H1043-Q1047 PolarHBondContact O-N 3.5Å
1044	G	93.6	Very high	89	Confident	0 Å²	0	28.5 Å²	28.5	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-63.7	-40.4	172	0	0	0	0	0	113.7	L992 R998 C1040 V1041 I1042 Q1047 T1048	L992-G1044 VanDerWaalsContact O-CA 3.25Å; L992-G1044 WeakPolarHBondContact O-CA 3.36Å; R998-G1044 PolarHBondContact NH1-O 2.97Å; C1040-G1044 PolarHBondContact O-N 3.12Å; V1041-G1044 WeakPolarHBondContact O-CA 3.2Å; V1041-G1044 PolarHBondContact O-N 3.09Å; I1042-G1044 PolarHBondContact O-N 2.83Å; G1044-Q1047 PolarHBondContact O-N 2.98Å; G1044-T1048 PolarHBondContact O-N 3.2Å; G1044-T1048 PolarHBondContact O-OG1 2.93Å
1045	L	94.4	Very high	88.7	Confident	0 Å²	0	28.7 Å²	28.7	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-67.7	-44.5	174.1	-64.9	172.1	0	0	0	111.7	V1041 I1042 Q1047 T1048 C1049 L1057 A1060 L1063 L1270	V1041-L1045 PolarHBondContact O-N 3.15Å; I1042-L1045 WeakPolarHBondContact O-CB 3.37Å; I1042-L1045 PolarHBondContact O-N 3.19Å; I1042-L1045 VanDerWaalsContact O-N 3.08Å; L1045-Q1047 VanDerWaalsContact C-N 3.28Å; L1045-Q1047 PolarHBondContact O-N 3.36Å; L1045-T1048 WeakPolarHBondContact O-CA 3.21Å; L1045-T1048 WeakPolarHBondContact O-CB 3.41Å; L1045-T1048 PolarHBondContact O-N 3.07Å; L1045-C1049 PolarHBondContact O-N 2.88Å; L1045-C1049 PolarHBondContact O-SG 3.18Å; L1045-C1049 VanDerWaalsContact O-SG 3.33Å; L1045-L1057 HydrophobicContact CD2-CD2 4.02Å; L1045-A1060 HydrophobicContact CD1-CB 3.82Å; L1045-A1060 HydrophobicContact CD2-CB 4.15Å; L1045-L1063 HydrophobicContact CD1-CD2 3.56Å; L1045-L1270 HydrophobicContact CB-CD2 3.75Å
1046	E	93.2	Very high	88.6	Confident	39 Å²	39	28.5 Å²	28.5	18%	0.182	16%	0.158	C	C	.	.	H	α-helix	trans	-56.2	-42	173.9	-72.1	175	172.9	0	0	112.1	I1042 T1050 F1128 S1268 L1270	I1042-E1046 HydrophobicContact CG2-CG 4.47Å; I1042-E1046 WeakPolarHBondContact O-CG 3.28Å; I1042-E1046 PolarHBondContact O-N 2.91Å; E1046-T1050 WeakPolarHBondContact O-CB 3.31Å; E1046-T1050 WeakPolarHBondContact O-CG2 3.41Å; E1046-T1050 PolarHBondContact O-N 2.97Å; E1046-T1050 PolarHBondContact O-OG1 3.23Å; E1046-F1128 HydrophobicContact CB-CD2 4.2Å; E1046-F1128 HydrophobicContact CB-CE2 4.06Å; E1046-F1128 HydrophobicContact CG-CD2 4.25Å; E1046-F1128 HydrophobicContact CG-CE2 4.19Å; E1046-S1268 WeakPolarHBondContact OE1-CB 3.48Å; E1046-S1268 PolarHBondContact OE1-OG 3.37Å; E1046-L1270 HydrophobicContact CG-CB 4.21Å; E1046-L1270 HydrophobicContact CG-CD2 4.29Å
1047	Q	90.1	Very high	88.8	Confident	62 Å²	62	28 Å²	28	29%	0.29	16%	0.157	S	C	.	.	H	α-helix	trans	-66	-38.3	173.3	-70.4	-66.8	-26.6	0	0	111.9	H1043 G1044 L1045 T1050 N1051	H1043-Q1047 VanDerWaalsContact O-CG 3.25Å; H1043-Q1047 WeakPolarHBondContact O-CG 3.47Å; H1043-Q1047 PolarHBondContact O-N 3.5Å; G1044-Q1047 PolarHBondContact O-N 2.98Å; L1045-Q1047 VanDerWaalsContact C-N 3.28Å; L1045-Q1047 PolarHBondContact O-N 3.36Å; Q1047-T1050 PolarHBondContact O-OG1 2.99Å; Q1047-N1051 WeakPolarHBondContact O-CB 3.31Å; Q1047-N1051 PolarHBondContact O-N 3.27Å; Q1047-N1051 VanDerWaalsContact O-N 3.08Å; Q1047-N1051 PolarHBondContact O-ND2 3.39Å
1048	T	90.5	Very high	88.8	Confident	18 Å²	18	28.2 Å²	28.2	11%	0.11	16%	0.158	C	C	.	.	H	α-helix	trans	-65.3	-47.5	177.4	-54.3	0	0	0	0	110.9	R998 G1044 L1045 N1051 H1052 L1057	R998-T1048 PolarHBondContact NH1-OG1 2.98Å; R998-T1048 PolarHBondContact NH2-OG1 2.78Å; G1044-T1048 PolarHBondContact O-N 3.2Å; G1044-T1048 PolarHBondContact O-OG1 2.93Å; L1045-T1048 WeakPolarHBondContact O-CA 3.21Å; L1045-T1048 WeakPolarHBondContact O-CB 3.41Å; L1045-T1048 PolarHBondContact O-N 3.07Å; T1048-N1051 CarbonylContact O-C 3.47Å; T1048-N1051 PolarHBondContact O-N 3.42Å; T1048-H1052 PolarHBondContact O-N 3.43Å; T1048-L1057 HydrophobicContact CG2-CD2 3.64Å; T1048-L1057 HydrophobicContact CG2-CG 4.21Å
1049	C	86.5	Confident	88.9	Confident	22 Å²	22	28.2 Å²	28.2	15%	0.149	16%	0.158	C	C	.	.	H	α-helix	trans	-65.3	-49.1	179.1	-63	0	0	0	0	113.1	L1045 N1051 H1052 L1057 L1270 F1276	L1045-C1049 PolarHBondContact O-N 2.88Å; L1045-C1049 PolarHBondContact O-SG 3.18Å; L1045-C1049 VanDerWaalsContact O-SG 3.33Å; C1049-N1051 PolarHBondContact O-N 3.43Å; C1049-H1052 PolarHBondContact O-N 3.29Å; C1049-L1057 WeakPolarHBondContact SG-CD2 3.3Å; C1049-L1270 HydrophobicContact CB-CD1 4.01Å; C1049-F1276 VanDerWaalsContact SG-CD2 3.53Å
1050	T	84.9	Confident	89.1	Confident	41 Å²	41	25.1 Å²	25.1	25%	0.252	14%	0.144	S	C	.	.	H	α-helix	trans	-61.2	-29.9	175.5	48.3	0	0	0	0	112.4	E1046 Q1047 H1052 L1127 F1128	E1046-T1050 WeakPolarHBondContact O-CB 3.31Å; E1046-T1050 WeakPolarHBondContact O-CG2 3.41Å; E1046-T1050 PolarHBondContact O-N 2.97Å; E1046-T1050 PolarHBondContact O-OG1 3.23Å; Q1047-T1050 PolarHBondContact O-OG1 2.99Å; T1050-H1052 VanDerWaalsContact C-N 3.28Å; T1050-H1052 PolarHBondContact O-CE1 3.2Å; T1050-H1052 PolarHBondContact O-N 3.03Å; T1050-H1052 PolarHBondContact O-ND1 3.49Å; T1050-L1127 HydrophobicContact CG2-CB 4.49Å; T1050-L1127 HydrophobicContact CG2-CD1 4.19Å; T1050-F1128 HydrophobicContact CG2-CD2 3.99Å; T1050-F1128 HydrophobicContact CG2-CE2 3.51Å; T1050-F1128 HydrophobicContact CG2-CZ 4.27Å
1051	N	82	Confident	89.1	Confident	81 Å²	81	25.9 Å²	25.9	43%	0.433	15%	0.147	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.7	-6.3	174.8	-79.7	-55.4	0	0	0	114.5	K477 Q1047 T1048 C1049 G1053	K477-N1051 WeakPolarHBondContact CD-O 3.4Å; K477-N1051 WeakPolarHBondContact CE-O 3.33Å; K477-N1051 PolarHBondContact NZ-O 3.34Å; K477-N1051 PolarHBondContact NZ-OD1 3.01Å; Q1047-N1051 WeakPolarHBondContact O-CB 3.31Å; Q1047-N1051 PolarHBondContact O-N 3.27Å; Q1047-N1051 VanDerWaalsContact O-N 3.08Å; Q1047-N1051 PolarHBondContact O-ND2 3.39Å; T1048-N1051 CarbonylContact O-C 3.47Å; T1048-N1051 PolarHBondContact O-N 3.42Å; C1049-N1051 PolarHBondContact O-N 3.43Å; N1051-G1053 PolarHBondContact O-N 3.04Å; N1051-G1053 VanDerWaalsContact O-N 3.12Å
1052	H	75.5	Confident	89.1	Confident	72 Å²	72	27.4 Å²	27.4	33%	0.333	16%	0.155	S	C	.	.	T	Hydrogen-bonded Turn	trans	41.1	50.5	179.3	-54.1	89	0	0	0	111.2	F473 S474 K477 T1048 C1049 T1050	F473-H1052 HydrophobicContact CB-CB 4.38Å; S474-H1052 WeakPolarHBondContact CA-O 3.46Å; K477-H1052 HydrophobicContact CD-CB 4.03Å; T1048-H1052 PolarHBondContact O-N 3.43Å; C1049-H1052 PolarHBondContact O-N 3.29Å; T1050-H1052 VanDerWaalsContact C-N 3.28Å; T1050-H1052 PolarHBondContact O-CE1 3.2Å; T1050-H1052 PolarHBondContact O-N 3.03Å; T1050-H1052 PolarHBondContact O-ND1 3.49Å
1053	G	72.9	Confident	89.1	Confident	34 Å²	34	26.9 Å²	26.9	35%	0.351	15%	0.152	S	C	.	.			trans	-68.5	175.9	-175.4	0	0	0	0	0	112.5	S474 N1051 G1055	S474-G1053 VanDerWaalsContact CB-O 3.26Å; S474-G1053 WeakPolarHBondContact CB-O 3.46Å; S474-G1053 VanDerWaalsContact OG-C 3.23Å; S474-G1053 PolarHBondContact OG-O 3.15Å; N1051-G1053 PolarHBondContact O-N 3.04Å; N1051-G1053 VanDerWaalsContact O-N 3.12Å; G1053-G1055 PolarHBondContact O-N 2.88Å
1054	I	78	Confident	89.2	Confident	61 Å²	61	24.6 Å²	24.6	31%	0.313	14%	0.142	S	C	.	.	S	Bend	trans	-79.5	98.8	163.6	-66.9	161.7	0	0	0	106.1	E455 S474 S859	E455-I1054 HydrophobicContact CB-CD1 4.18Å; E455-I1054 WeakPolarHBondContact O-CG2 3.25Å; S474-I1054 WeakPolarHBondContact OG-CG1 3.44Å; S474-I1054 PolarHBondContact OG-N 3.24Å; S859-I1054 WeakPolarHBondContact OG-CD1 3.23Å
1055	G	84.2	Confident	89.3	Confident	10 Å²	10	25 Å²	25	10%	0.103	14%	0.143	C	C	.	.			trans	54.8	-153.8	-171.7	0	0	0	0	0	115.1	R458 G1053 D1283	R458-G1055 VanDerWaalsContact NH2-N 3.11Å; G1053-G1055 PolarHBondContact O-N 2.88Å; G1055-D1283 VanDerWaalsContact CA-CG 3.44Å; G1055-D1283 WeakPolarHBondContact CA-OD1 3.09Å; G1055-D1283 WeakPolarHBondContact CA-OD2 3.31Å
1056	G	88.7	Confident	89.2	Confident	12 Å²	12	25 Å²	25	12%	0.124	14%	0.143	C	C	.	.			trans	116.4	3.3	-179.9	0	0	0	0	0	114.6	E995 R998 S1059 D1283	E995-G1056 WeakPolarHBondContact OE2-CA 3.39Å; R998-G1056 PolarHBondContact NH2-O 3.04Å; G1056-S1059 PolarHBondContact O-OG 2.97Å; G1056-D1283 PolarHBondContact N-OD2 3.1Å
1057	L	94.2	Very high	89.3	Confident	7 Å²	7	23.2 Å²	23.2	4%	0.037	14%	0.135	C	C	.	.			trans	-108.8	-6.8	-166.8	-60.9	177.7	0	0	0	115.4	E995 L1045 T1048 C1049 S1059 A1060 F1276 D1279 D1283	E995-L1057 PolarHBondContact OE1-N 3.37Å; L1045-L1057 HydrophobicContact CD2-CD2 4.02Å; T1048-L1057 HydrophobicContact CG2-CD2 3.64Å; T1048-L1057 HydrophobicContact CG2-CG 4.21Å; C1049-L1057 WeakPolarHBondContact SG-CD2 3.3Å; L1057-S1059 PolarHBondContact O-N 2.63Å; L1057-A1060 WeakPolarHBondContact O-CB 3.32Å; L1057-A1060 PolarHBondContact O-N 2.94Å; L1057-F1276 HydrophobicContact CD1-CD2 4.21Å; L1057-F1276 HydrophobicContact CD2-CD2 4.42Å; L1057-F1276 HydrophobicContact CD2-CE2 4.39Å; L1057-D1279 HydrophobicContact CD1-CB 3.65Å; L1057-D1283 PolarHBondContact N-OD2 2.76Å
1058	A	94	Very high	89.5	Confident	3 Å²	3	20.5 Å²	20.5	3%	0.025	12%	0.122	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.6	-34.8	177.1	0	0	0	0	0	112.6	E995 A1060 M1061 D1283 Q1287	E995-A1058 PolarHBondContact OE1-N 2.7Å; E995-A1058 VanDerWaalsContact OE1-N 3.09Å; A1058-A1060 PolarHBondContact O-N 3.41Å; A1058-M1061 PolarHBondContact O-N 3.06Å; A1058-D1283 HydrophobicContact CB-CB 4.22Å; A1058-Q1287 HydrophobicContact CB-CB 4.22Å
1059	S	95.1	Very high	89.5	Confident	0 Å²	0	19.7 Å²	19.7	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-51.4	-22.4	171	48.1	0	0	0	0	114.9	E995 R998 N999 L1002 G1056 L1057 L1063	E995-S1059 VanDerWaalsContact OE1-CB 3.32Å; E995-S1059 WeakPolarHBondContact OE1-CB 3.14Å; E995-S1059 PolarHBondContact OE1-N 3.37Å; E995-S1059 PolarHBondContact OE1-OG 3.09Å; R998-S1059 PolarHBondContact NE-OG 3.33Å; N999-S1059 VanDerWaalsContact OD1-CA 3.29Å; N999-S1059 WeakPolarHBondContact OD1-CA 3.31Å; N999-S1059 WeakPolarHBondContact OD1-CB 3.46Å; L1002-S1059 WeakPolarHBondContact CD1-O 3.47Å; G1056-S1059 PolarHBondContact O-OG 2.97Å; L1057-S1059 PolarHBondContact O-N 2.63Å; S1059-L1063 PolarHBondContact O-N 2.99Å
1060	A	96.3	Very high	89.8	Confident	0 Å²	0	19.1 Å²	19.1	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-66.4	-33.9	174.3	0	0	0	0	0	112.7	L1045 L1057 A1058 M1062 L1063 L1064 F1276 T1280	L1045-A1060 HydrophobicContact CD1-CB 3.82Å; L1045-A1060 HydrophobicContact CD2-CB 4.15Å; L1057-A1060 WeakPolarHBondContact O-CB 3.32Å; L1057-A1060 PolarHBondContact O-N 2.94Å; A1058-A1060 PolarHBondContact O-N 3.41Å; A1060-M1062 PolarHBondContact O-N 3.28Å; A1060-L1063 WeakPolarHBondContact O-CB 3.18Å; A1060-L1063 PolarHBondContact O-N 3.39Å; A1060-L1064 HydrophobicContact CB-CD1 4.49Å; A1060-L1064 WeakPolarHBondContact O-CB 2.97Å; A1060-L1064 VanDerWaalsContact O-CD1 3.31Å; A1060-L1064 WeakPolarHBondContact O-CD1 3.31Å; A1060-L1064 WeakPolarHBondContact O-CG 3.21Å; A1060-L1064 PolarHBondContact O-N 3.28Å; A1060-F1276 HydrophobicContact CB-CE2 4.07Å; A1060-F1276 HydrophobicContact CB-CZ 3.84Å; A1060-T1280 HydrophobicContact CB-CG2 3.92Å
1061	M	95.2	Very high	90.1	Very high	20 Å²	20	18.3 Å²	18.3	10%	0.099	11%	0.105	C	C	.	.	H	α-helix	trans	-66.9	-39.1	178.9	-65.4	-67.8	-85.7	0	0	111.5	A1058 L1064 E1065 T1280 T1284 N1330 L1331 Y1334	A1058-M1061 PolarHBondContact O-N 3.06Å; M1061-L1064 PolarHBondContact O-N 3.01Å; M1061-E1065 PolarHBondContact O-N 3.05Å; M1061-T1280 HydrophobicContact CG-CG2 4Å; M1061-T1280 HydrophobicContact SD-CG2 4.16Å; M1061-T1284 HydrophobicContact CB-CG2 4.44Å; M1061-T1284 HydrophobicContact CE-CG2 4.44Å; M1061-T1284 HydrophobicContact CG-CG2 3.84Å; M1061-T1284 WeakPolarHBondContact CG-OG1 3.44Å; M1061-N1330 HydrophobicContact CE-CB 4.13Å; M1061-L1331 HydrophobicContact CE-CB 4.49Å; M1061-L1331 HydrophobicContact SD-CD1 4.02Å; M1061-Y1334 HydrophobicContact CB-CE2 4.47Å; M1061-Y1334 HydrophobicContact CE-CD2 3.99Å; M1061-Y1334 HydrophobicContact CE-CE2 3.66Å; M1061-Y1334 HydrophobicContact SD-CD2 3.58Å; M1061-Y1334 VanDerWaalsContact SD-CD2 3.58Å; M1061-Y1334 HydrophobicContact SD-CE2 3.59Å; M1061-Y1334 VanDerWaalsContact SD-CE2 3.59Å
1062	M	93.4	Very high	90.5	Very high	33 Å²	33	14.6 Å²	14.6	16%	0.163	9%	0.085	C	C	.	.	H	α-helix	trans	-65.3	-38.5	173.6	-63.4	176.5	73.3	0	0	112.4	N999 L1002 L1009 A1060 L1066	N999-M1062 HydrophobicContact CB-SD 4.41Å; N999-M1062 PolarHBondContact OD1-SD 3.1Å; N999-M1062 VanDerWaalsContact OD1-SD 3.36Å; L1002-M1062 HydrophobicContact CB-CB 4.2Å; L1002-M1062 HydrophobicContact CB-CE 4.01Å; L1002-M1062 HydrophobicContact CD1-CB 3.99Å; L1009-M1062 HydrophobicContact CD1-CE 3.45Å; L1009-M1062 VanDerWaalsContact CD1-CE 3.45Å; L1009-M1062 HydrophobicContact CD2-CE 4.44Å; A1060-M1062 PolarHBondContact O-N 3.28Å; M1062-L1066 PolarHBondContact O-N 3.16Å
1063	L	95.3	Very high	90.8	Very high	1 Å²	1	13 Å²	13	1%	0.005	8%	0.079	C	C	.	.	H	α-helix	trans	-61.3	-46.8	173.6	170	70.4	0	0	0	110.6	L1002 L1038 V1041 I1042 L1045 S1059 A1060 L1066 C1067 W1271	L1002-L1063 HydrophobicContact CD1-CB 4.11Å; L1002-L1063 HydrophobicContact CD2-CB 4.43Å; L1002-L1063 HydrophobicContact CD2-CD1 4.38Å; L1038-L1063 HydrophobicContact CB-CD1 4.16Å; L1038-L1063 HydrophobicContact CD2-CD1 3.3Å; L1038-L1063 HydrophobicContact CG-CD1 4.22Å; V1041-L1063 HydrophobicContact CB-CD1 4.23Å; V1041-L1063 HydrophobicContact CG1-CD1 4.06Å; V1041-L1063 HydrophobicContact CG1-CD2 4.12Å; V1041-L1063 HydrophobicContact CG1-CG 4.48Å; I1042-L1063 HydrophobicContact CG1-CD2 3.86Å; L1045-L1063 HydrophobicContact CD1-CD2 3.56Å; S1059-L1063 PolarHBondContact O-N 2.99Å; A1060-L1063 WeakPolarHBondContact O-CB 3.18Å; A1060-L1063 PolarHBondContact O-N 3.39Å; L1063-L1066 PolarHBondContact O-N 2.79Å; L1063-C1067 PolarHBondContact O-N 3.35Å; L1063-C1067 PolarHBondContact O-SG 2.67Å; L1063-W1271 HydrophobicContact CD2-CH2 4.29Å
1064	L	96	Very high	90.9	Very high	1 Å²	1	13.3 Å²	13.3	1%	0.005	7%	0.072	C	C	.	.	H	α-helix	trans	-72.7	-34.6	-176.2	-67	160.2	0	0	0	112.1	A1060 M1061 L1066 C1067 H1068 W1271 W1277 Y1334 M1338	A1060-L1064 HydrophobicContact CB-CD1 4.49Å; A1060-L1064 WeakPolarHBondContact O-CB 2.97Å; A1060-L1064 VanDerWaalsContact O-CD1 3.31Å; A1060-L1064 WeakPolarHBondContact O-CD1 3.31Å; A1060-L1064 WeakPolarHBondContact O-CG 3.21Å; A1060-L1064 PolarHBondContact O-N 3.28Å; M1061-L1064 PolarHBondContact O-N 3.01Å; L1064-L1066 VanDerWaalsContact C-N 3.35Å; L1064-L1066 PolarHBondContact O-N 3.36Å; L1064-C1067 PolarHBondContact O-N 3.02Å; L1064-H1068 WeakPolarHBondContact O-CB 3.12Å; L1064-H1068 PolarHBondContact O-N 3.37Å; L1064-W1271 HydrophobicContact CD2-CH2 4.46Å; L1064-W1271 HydrophobicContact CD2-CZ3 4.43Å; L1064-W1277 HydrophobicContact CD1-CH2 4.23Å; L1064-W1277 HydrophobicContact CD1-CZ3 3.9Å; L1064-Y1334 VanDerWaalsContact C-CE1 3.5Å; L1064-Y1334 HydrophobicContact CB-CD1 3.6Å; L1064-Y1334 HydrophobicContact CB-CD2 3.71Å; L1064-Y1334 HydrophobicContact CB-CE1 3.84Å; L1064-Y1334 HydrophobicContact CB-CE2 3.96Å; L1064-Y1334 HydrophobicContact CB-CG 3.53Å; L1064-Y1334 HydrophobicContact CD1-CD2 4.01Å; L1064-Y1334 HydrophobicContact CD1-CG 4.09Å; L1064-Y1334 HydrophobicContact CG-CD2 4.47Å; L1064-Y1334 HydrophobicContact CG-CG 4.28Å; L1064-M1338 HydrophobicContact CD2-CG 3.65Å; L1064-M1338 HydrophobicContact CD2-SD 3.98Å
1065	E	94.9	Very high	90	Very high	7 Å²	7	13.6 Å²	13.6	3%	0.033	8%	0.079	C	C	.	.	H	α-helix	trans	-57.4	-47.1	169.9	-173.9	-177.2	136.7	0	0	111	N1006 I1020 M1061 H1068 T1069 Y1334 L1383 R1389	N1006-E1065 PolarHBondContact ND2-OE1 2.94Å; N1006-E1065 VanDerWaalsContact ND2-OE1 3.13Å; I1020-E1065 HydrophobicContact CD1-CG 4.26Å; M1061-E1065 PolarHBondContact O-N 3.05Å; E1065-H1068 PolarHBondContact O-N 2.88Å; E1065-T1069 HydrophobicContact CG-CG2 4.34Å; E1065-T1069 WeakPolarHBondContact O-CB 3.46Å; E1065-T1069 WeakPolarHBondContact O-CG2 3.43Å; E1065-T1069 PolarHBondContact O-N 3.01Å; E1065-T1069 PolarHBondContact O-OG1 2.93Å; E1065-Y1334 WeakPolarHBondContact CA-OH 3.25Å; E1065-Y1334 WeakPolarHBondContact CB-OH 3.35Å; E1065-Y1334 PolarHBondContact N-OH 3.24Å; E1065-L1383 HydrophobicContact CG-CD1 4.17Å; E1065-R1389 IonicContact OE1-CZ 3.27Å; E1065-R1389 IonicContact OE1-NH1 3.28Å; E1065-R1389 PolarHBondContact OE1-NH1 3.45Å; E1065-R1389 IonicContact OE1-NH2 2.8Å; E1065-R1389 IonicContact OE2-NH1 2.83Å; E1065-R1389 PolarHBondContact OE2-NH1 2.86Å
1066	L	93.7	Very high	88.6	Confident	1 Å²	1	17.9 Å²	17.9	1%	0.005	10%	0.104	C	C	.	.	H	α-helix	trans	-62	-46.2	176.8	-173.6	95.5	0	0	0	111	L1005 N1006 L1038 M1062 L1063 L1064 H1068 T1069 H1070 L1257	L1005-L1066 HydrophobicContact CD2-CD2 3.67Å; L1005-L1066 HydrophobicContact CG-CD1 4.29Å; L1005-L1066 HydrophobicContact CG-CD2 4.3Å; N1006-L1066 HydrophobicContact CB-CD1 3.58Å; L1038-L1066 HydrophobicContact CD1-CD2 4.15Å; L1038-L1066 HydrophobicContact CD2-CD2 3.42Å; L1038-L1066 VanDerWaalsContact CD2-CD2 3.42Å; L1038-L1066 HydrophobicContact CG-CD2 4.3Å; M1062-L1066 PolarHBondContact O-N 3.16Å; L1063-L1066 PolarHBondContact O-N 2.79Å; L1064-L1066 VanDerWaalsContact C-N 3.35Å; L1064-L1066 PolarHBondContact O-N 3.36Å; L1066-H1068 PolarHBondContact O-N 2.67Å; L1066-T1069 PolarHBondContact O-N 2.82Å; L1066-H1070 WeakPolarHBondContact O-CB 3.42Å; L1066-H1070 PolarHBondContact O-N 2.96Å; L1066-L1257 HydrophobicContact CD2-CD1 4.08Å; L1066-L1257 HydrophobicContact CG-CD1 4.16Å
1067	C	94.3	Very high	86.8	Confident	2 Å²	2	19.3 Å²	19.3	1%	0.014	12%	0.115	C	C	.	.	H	α-helix	trans	-59.1	-34.6	177.7	-69.8	0	0	0	0	113.3	L1063 L1064 Y1258 L1261 L1337	L1063-C1067 PolarHBondContact O-N 3.35Å; L1063-C1067 PolarHBondContact O-SG 2.67Å; L1064-C1067 PolarHBondContact O-N 3.02Å; C1067-Y1258 PolarHBondContact O-N 3.14Å; C1067-L1261 VanDerWaalsContact SG-CD1 3.5Å; C1067-L1337 HydrophobicContact CB-CD2 4.21Å
1068	H	93.5	Very high	84.1	Confident	4 Å²	4	24.6 Å²	24.6	2%	0.019	15%	0.147	C	C	.	.	H	α-helix	trans	-78	-42.8	-178.6	-168.4	-76.5	0	0	0	113.1	L1064 E1065 L1066 Y1256 Y1334 L1337 N1379 I1381 L1383	L1064-H1068 WeakPolarHBondContact O-CB 3.12Å; L1064-H1068 PolarHBondContact O-N 3.37Å; E1065-H1068 PolarHBondContact O-N 2.88Å; L1066-H1068 PolarHBondContact O-N 2.67Å; H1068-Y1256 VanDerWaalsContact O-CD1 3.32Å; H1068-Y1256 WeakPolarHBondContact O-CD1 3.45Å; H1068-Y1334 HydrophobicContact CB-CE1 4.26Å; H1068-L1337 HydrophobicContact CB-CD2 3.89Å; H1068-N1379 WeakPolarHBondContact NE2-CA 3.28Å; H1068-I1381 PolarHBondContact CE1-O 2.73Å; H1068-I1381 PolarHBondContact NE2-O 3.22Å; H1068-L1383 HydrophobicContact CB-CD1 3.84Å
1069	T	91.9	Very high	80.9	Confident	2 Å²	2	32.1 Å²	32.1	1%	0.012	19%	0.186	C	C	.	.	H	α-helix	trans	-92.1	-30.6	-169	53.9	0	0	0	0	113.8	I1020 D1022 V1023 E1065 L1066 L1383	I1020-T1069 HydrophobicContact CG2-CG2 3.84Å; D1022-T1069 CarbonylContact C-O 3.53Å; D1022-T1069 WeakPolarHBondContact CA-O 3.42Å; V1023-T1069 PolarHBondContact N-O 2.87Å; E1065-T1069 HydrophobicContact CG-CG2 4.34Å; E1065-T1069 WeakPolarHBondContact O-CB 3.46Å; E1065-T1069 WeakPolarHBondContact O-CG2 3.43Å; E1065-T1069 PolarHBondContact O-N 3.01Å; E1065-T1069 PolarHBondContact O-OG1 2.93Å; L1066-T1069 PolarHBondContact O-N 2.82Å; T1069-L1383 HydrophobicContact CG2-CD1 4.18Å
1070	H	92.1	Very high	77.8	Confident	10 Å²	10	38 Å²	38	5%	0.046	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91	128.1	-170.8	-70.4	51.5	0	0	0	112.5	N1006 V1023 I1025 L1066 L1257	N1006-H1070 PolarHBondContact OD1-CE1 2.87Å; V1023-H1070 VanDerWaalsContact O-CA 3.3Å; V1023-H1070 WeakPolarHBondContact O-CA 3.32Å; I1025-H1070 HydrophobicContact CD1-CB 4.06Å; I1025-H1070 HydrophobicContact CG1-CB 4.14Å; L1066-H1070 WeakPolarHBondContact O-CB 3.42Å; L1066-H1070 PolarHBondContact O-N 2.96Å; H1070-L1257 HydrophobicContact CB-CD1 3.67Å; H1070-L1257 HydrophobicContact CB-CG 4.27Å; H1070-L1257 PolarHBondContact O-N 3.49Å; H1070-L1257 VanDerWaalsContact O-N 3.12Å
1071	Y	91.1	Very high	74.6	Confident	24 Å²	24	42.5 Å²	42.5	9%	0.094	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	150.2	-175.2	71.3	-84.9	0	0	0	113.7	D1022 V1023 P1024 I1025 N1073 R1254 V1255 Y1256	D1022-Y1071 HydrophobicContact CB-CD1 3.92Å; D1022-Y1071 HydrophobicContact CB-CE1 3.67Å; V1023-Y1071 WeakPolarHBondContact O-CD1 3.48Å; V1023-Y1071 PolarHBondContact O-N 3.25Å; P1024-Y1071 CarbonylContact C-O 3.48Å; P1024-Y1071 WeakPolarHBondContact CA-O 3.45Å; P1024-Y1071 HydrophobicContact CB-CE1 4.26Å; P1024-Y1071 HydrophobicContact CB-CE2 4.25Å; I1025-Y1071 PolarHBondContact N-O 3.32Å; Y1071-N1073 HydrophobicContact CE2-CB 4.17Å; Y1071-R1254 HydrophobicContact CD2-CB 3.79Å; Y1071-R1254 HydrophobicContact CD2-CG 3.59Å; Y1071-R1254 HydrophobicContact CE2-CB 4.4Å; Y1071-R1254 HydrophobicContact CE2-CG 3.68Å; Y1071-R1254 HydrophobicContact CG-CB 4.33Å; Y1071-R1254 HydrophobicContact CG-CG 4.41Å; Y1071-V1255 CarbonylContact C-O 3.29Å; Y1071-V1255 WeakPolarHBondContact CA-O 3.23Å; Y1071-Y1256 HydrophobicContact CD1-CE1 4.1Å; Y1071-Y1256 HydrophobicContact CG-CE1 4.19Å
1072	L	89.4	Confident	71.4	Confident	2 Å²	2	50.4 Å²	50.4	1%	0.01	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	133.7	166.6	-178.2	64.7	0	0	0	110	M1028 Y1031 M1074 R1254 V1255	M1028-L1072 HydrophobicContact CE-CD2 3.44Å; M1028-L1072 VanDerWaalsContact CE-CD2 3.44Å; M1028-L1072 HydrophobicContact SD-CD2 3.71Å; Y1031-L1072 HydrophobicContact CD2-CB 3.66Å; Y1031-L1072 HydrophobicContact CD2-CD2 4.42Å; Y1031-L1072 HydrophobicContact CE2-CB 4.27Å; Y1031-L1072 HydrophobicContact CG-CB 4.17Å; Y1031-L1072 HydrophobicContact CG-CD2 4.11Å; L1072-M1074 HydrophobicContact CD2-CE 4.09Å; L1072-M1074 HydrophobicContact CD2-SD 3.9Å; L1072-M1074 HydrophobicContact CG-SD 4.01Å; L1072-R1254 WeakPolarHBondContact O-CA 3.36Å; L1072-V1255 PolarHBondContact N-O 2.75Å; L1072-V1255 PolarHBondContact O-N 3.26Å
1073	N	83.4	Confident	68.3	Low	39 Å²	39	57.1 Å²	57.1	21%	0.209	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	113	171	-175.6	-4.4	0	0	0	110.4	Y1071 S1075 T1076 N1253	Y1071-N1073 HydrophobicContact CE2-CB 4.17Å; N1073-S1075 VanDerWaalsContact C-N 3.31Å; N1073-S1075 VanDerWaalsContact CG-OG 3.28Å; N1073-S1075 PolarHBondContact ND2-OG 3.47Å; N1073-S1075 PolarHBondContact O-N 2.74Å; N1073-S1075 PolarHBondContact OD1-N 3Å; N1073-S1075 VanDerWaalsContact OD1-N 3.13Å; N1073-S1075 PolarHBondContact OD1-OG 3.37Å; N1073-T1076 WeakPolarHBondContact CB-OG1 3.28Å; N1073-T1076 PolarHBondContact O-N 2.84Å; N1073-T1076 PolarHBondContact O-OG1 3.18Å; N1073-N1253 CarbonylContact C-O 3.54Å; N1073-N1253 WeakPolarHBondContact CA-O 3.43Å; N1073-N1253 PolarHBondContact OD1-O 2.86Å
1074	M	73.8	Confident	65	Low	40 Å²	40	66.6 Å²	66.6	20%	0.197	37%	0.368	C	S	.	.	G	3₁₀ helix	trans	-64.6	-32	-177.9	-100.1	45.6	-177.9	0	0	113.2	M1028 L1072 T1076 A1077 F1104 N1253 V1255	M1028-M1074 HydrophobicContact CE-CE 4.04Å; L1072-M1074 HydrophobicContact CD2-CE 4.09Å; L1072-M1074 HydrophobicContact CD2-SD 3.9Å; L1072-M1074 HydrophobicContact CG-SD 4.01Å; M1074-T1076 PolarHBondContact O-N 3.2Å; M1074-A1077 PolarHBondContact O-N 2.95Å; M1074-F1104 HydrophobicContact CE-CD1 3.85Å; M1074-F1104 HydrophobicContact CE-CE1 3.15Å; M1074-F1104 HydrophobicContact CE-CE2 4.24Å; M1074-F1104 HydrophobicContact CE-CZ 3.42Å; M1074-F1104 VanDerWaalsContact CE-CZ 3.42Å; M1074-N1253 HydrophobicContact CB-CB 4.37Å; M1074-N1253 PolarHBondContact N-O 3.46Å; M1074-V1255 HydrophobicContact CE-CB 4.31Å; M1074-V1255 HydrophobicContact CE-CG2 3.69Å; M1074-V1255 HydrophobicContact SD-CB 4.36Å; M1074-V1255 HydrophobicContact SD-CG2 3.83Å
1075	S	59.7	Low	61.8	Low	67 Å²	67	70.3 Å²	70.3	47%	0.469	41%	0.408	S	S	.	.	G	3₁₀ helix	trans	-64.8	-24.4	179.6	63.7	0	0	0	0	113.6	N1073	N1073-S1075 VanDerWaalsContact C-N 3.31Å; N1073-S1075 VanDerWaalsContact CG-OG 3.28Å; N1073-S1075 PolarHBondContact ND2-OG 3.47Å; N1073-S1075 PolarHBondContact O-N 2.74Å; N1073-S1075 PolarHBondContact OD1-N 3Å; N1073-S1075 VanDerWaalsContact OD1-N 3.13Å; N1073-S1075 PolarHBondContact OD1-OG 3.37Å
1076	T	55.1	Low	58.6	Low	101 Å²	101	75 Å²	75	62%	0.62	44%	0.441	S	S	*	.	G	3₁₀ helix	trans	-95.4	-8.5	177.7	36.9	0	0	0	0	114.4	N1073 M1074	N1073-T1076 WeakPolarHBondContact CB-OG1 3.28Å; N1073-T1076 PolarHBondContact O-N 2.84Å; N1073-T1076 PolarHBondContact O-OG1 3.18Å; M1074-T1076 PolarHBondContact O-N 3.2Å
1077	A	50.4	Low	55.5	Low	42 Å²	42	82.1 Å²	82.1	35%	0.347	47%	0.474	S	S	.	.	S	Bend	trans	-84.7	-9.2	-171.9	0	0	0	0	0	114.7	M1074	M1074-A1077 PolarHBondContact O-N 2.95Å
1078	V	37.8	Very low	52.2	Low	118 Å²	118	91.7 Å²	91.7	72%	0.715	51%	0.511	S	S	*	.			trans	-123.8	83.9	-174.7	-172.2	0	0	0	0	111.3
1079	L	26.1	Very low	49.2	Very low	161 Å²	161	96.6 Å²	96.6	84%	0.843	55%	0.546	S	S	*	.			trans	-152.6	111.5	161.5	-147.1	85.4	0	0	0	112.8
1080	P	31.1	Very low	45.9	Very low	124 Å²	124	102.4 Å²	102.4	81%	0.805	58%	0.582	S	S	*	*			trans	-125.3	102.6	150.8	32.8	-19.6	0	0	0	111.1
1081	S	27.7	Very low	42.7	Very low	93 Å²	93	108 Å²	108	65%	0.65	61%	0.612	S	S	*	*			trans	-64.4	142.9	160.4	67.3	0	0	0	0	109.5
1082	K	28.5	Very low	39.7	Very low	187 Å²	187	114.5 Å²	114.5	81%	0.813	64%	0.643	S	S	*	*			cis	-154.4	154.9	18.3	-63.9	165.1	172	161.6	0	109.4
1083	L	29.1	Very low	36.8	Very low	174 Å²	174	121.6 Å²	121.6	91%	0.911	68%	0.681	S	S	*	*				-173.4	158.1	115.2	-123.7	81.5	0	0	0	112.5
1084	H	25.6	Very low	34.1	Very low	199 Å²	199	125.2 Å²	125.2	92%	0.921	71%	0.71	S	S	*	*			trans	-79.6	153.8	-177.5	-73.4	-35.1	0	0	0	114.7
1085	G	28.8	Very low	31.8	Very low	80 Å²	80	132.3 Å²	132.3	83%	0.825	74%	0.742	S	S	*	*			trans	174.8	84.1	166.2	0	0	0	0	0	115.4
1086	S	26.9	Very low	30.1	Very low	104 Å²	104	136.7 Å²	136.7	73%	0.727	76%	0.755	S	S	*	*			trans	-58.7	157.1	171.5	100.7	0	0	0	0	112.6
1087	Q	28.9	Very low	28.9	Very low	151 Å²	151	140.5 Å²	140.5	71%	0.706	77%	0.766	S	S	*	*			cis	-168.2	159.6	30.2	-121.6	174.8	29.8	0	0	111.4
1088	Y	25.8	Very low	28	Very low	203 Å²	203	147.2 Å²	147.2	80%	0.796	79%	0.79	S	S	*	*			trans	34.2	138.4	157.8	-55.9	-61.4	0	0	0	121.3
1089	S	28.9	Very low	28	Very low	108 Å²	108	146 Å²	146	76%	0.755	78%	0.78	S	S	*	*			cis	-157	165.2	45.2	57.7	0	0	0	0	116.1
1090	T	24.4	Very low	28.3	Very low	123 Å²	123	144.9 Å²	144.9	76%	0.755	77%	0.774	S	S	*	*			trans	-39.7	155.2	166.3	6.5	0	0	0	0	114.7
1091	N	24.7	Very low	28.5	Very low	129 Å²	129	144.1 Å²	144.1	69%	0.69	77%	0.767	S	S	*	*			cis	-169.6	162.5	40.5	-143.3	-3.4	0	0	0	113.2
1092	Q	27.4	Very low	29	Very low	160 Å²	160	142.7 Å²	142.7	75%	0.748	76%	0.757	S	S	*	*			trans	61	122.6	161.2	-65.7	176.6	1.6	0	0	117.8
1093	N	28.4	Very low	29.3	Very low	150 Å²	150	136.7 Å²	136.7	80%	0.802	74%	0.742	S	S	*	*			cis	-163.2	159	42.8	-92.5	-30.8	0	0	0	111.4
1094	S	26	Very low	29.7	Very low	116 Å²	116	131 Å²	131	81%	0.811	71%	0.71	S	S	*	*			trans	-95.8	99.6	179.8	50.7	0	0	0	0	112.9
1095	Q	26.7	Very low	30.2	Very low	189 Å²	189	124.1 Å²	124.1	88%	0.883	68%	0.682	S	S	*	*			trans	-168	46.2	164.9	-124.2	176.6	3.6	0	0	114.9
1096	E	24.4	Very low	30.6	Very low	158 Å²	158	121.7 Å²	121.7	74%	0.738	66%	0.657	S	S	*	*			trans	-140	85.9	177.8	-68.5	-161.5	131.8	0	0	114.1	N1099	E1096-N1099 PolarHBondContact OE1-ND2 3.27Å
1097	E	28.3	Very low	31.2	Very low	182 Å²	182	122.6 Å²	122.6	85%	0.85	65%	0.645	S	S	*	*	S	Bend	trans	-125.5	-17.6	160.2	-77.6	-168.3	143.2	0	0	114.1	N1099	E1097-N1099 VanDerWaalsContact C-N 3.34Å; E1097-N1099 PolarHBondContact O-N 2.93Å
1098	E	31.8	Very low	31.3	Very low	183 Å²	183	116.1 Å²	116.1	86%	0.855	62%	0.615	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78	-13.5	176.1	-65.4	-170.7	144.7	0	0	114.2
1099	N	38.8	Very low	31.9	Very low	93 Å²	93	113.7 Å²	113.7	50%	0.497	60%	0.604	S	S	.	*	H	α-helix	trans	-81.1	-15.9	-172.9	-108.2	-16.9	0	0	0	114.9	E1096 E1097 S1102 A1103	E1096-N1099 PolarHBondContact OE1-ND2 3.27Å; E1097-N1099 VanDerWaalsContact C-N 3.34Å; E1097-N1099 PolarHBondContact O-N 2.93Å; N1099-S1102 PolarHBondContact O-OG 3.31Å; N1099-S1102 VanDerWaalsContact O-OG 3.12Å; N1099-A1103 WeakPolarHBondContact O-CB 3.47Å; N1099-A1103 PolarHBondContact O-N 3.3Å
1100	L	32.9	Very low	32.2	Very low	136 Å²	136	111.9 Å²	111.9	71%	0.712	59%	0.589	S	S	*	*	H	α-helix	trans	-76.4	-38.3	-175.7	-70.3	175.5	0	0	0	112.9	F1104	L1100-F1104 WeakPolarHBondContact O-CB 3.18Å; L1100-F1104 PolarHBondContact O-N 2.99Å
1101	V	35.3	Very low	32.5	Very low	108 Å²	108	108 Å²	108	66%	0.655	57%	0.565	S	S	*	*	H	α-helix	trans	-71.3	-38.1	178	-177.5	0	0	0	0	111	F1104 T1105	V1101-F1104 PolarHBondContact O-N 2.91Å; V1101-T1105 WeakPolarHBondContact O-CB 3.3Å; V1101-T1105 WeakPolarHBondContact O-CG2 3.4Å; V1101-T1105 PolarHBondContact O-N 2.78Å; V1101-T1105 PolarHBondContact O-OG1 2.91Å
1102	S	36.4	Very low	32.9	Very low	63 Å²	63	103.6 Å²	103.6	44%	0.441	54%	0.543	S	S	.	.	H	α-helix	trans	-69.8	-41.2	175.6	71.7	0	0	0	0	112.2	N1099 T1105 G1106	N1099-S1102 PolarHBondContact O-OG 3.31Å; N1099-S1102 VanDerWaalsContact O-OG 3.12Å; S1102-T1105 PolarHBondContact O-OG1 3.22Å; S1102-T1105 VanDerWaalsContact O-OG1 3.12Å; S1102-G1106 PolarHBondContact O-N 3.47Å
1103	A	36.3	Very low	33.2	Very low	61 Å²	61	102.7 Å²	102.7	50%	0.504	54%	0.536	S	S	.	.	H	α-helix	trans	-66.1	-37.3	173.8	0	0	0	0	0	112.2	N1099 G1106 W1107	N1099-A1103 WeakPolarHBondContact O-CB 3.47Å; N1099-A1103 PolarHBondContact O-N 3.3Å; A1103-G1106 CarbonylContact O-C 3.59Å; A1103-G1106 PolarHBondContact O-N 3Å; A1103-W1107 WeakPolarHBondContact O-CB 3.21Å; A1103-W1107 PolarHBondContact O-N 2.94Å
1104	F	36.9	Very low	33.3	Very low	55 Å²	55	101.5 Å²	101.5	24%	0.241	53%	0.53	C	S	.	.	H	α-helix	trans	-74	-43.6	-179.5	-175.6	-95.6	0	0	0	113	M1028 M1074 L1100 V1101 G1106 W1107 L1108	M1028-F1104 HydrophobicContact CE-CE1 4.49Å; M1028-F1104 HydrophobicContact CE-CE2 3.66Å; M1028-F1104 HydrophobicContact CE-CZ 3.36Å; M1028-F1104 HydrophobicContact SD-CE2 4.5Å; M1028-F1104 HydrophobicContact SD-CZ 3.93Å; M1074-F1104 HydrophobicContact CE-CD1 3.85Å; M1074-F1104 HydrophobicContact CE-CE1 3.15Å; M1074-F1104 HydrophobicContact CE-CE2 4.24Å; M1074-F1104 HydrophobicContact CE-CZ 3.42Å; M1074-F1104 VanDerWaalsContact CE-CZ 3.42Å; L1100-F1104 WeakPolarHBondContact O-CB 3.18Å; L1100-F1104 PolarHBondContact O-N 2.99Å; V1101-F1104 PolarHBondContact O-N 2.91Å; F1104-G1106 VanDerWaalsContact C-N 3.27Å; F1104-G1106 PolarHBondContact O-N 2.64Å; F1104-W1107 HydrophobicContact CD2-CE3 4.02Å; F1104-W1107 AromaticContact CE2-CE3 3.57Å; F1104-W1107 HydrophobicContact CE2-CE3 3.57Å; F1104-W1107 AromaticContact CE2-CZ3 3.69Å; F1104-W1107 HydrophobicContact CE2-CZ3 3.69Å; F1104-W1107 HydrophobicContact CZ-CE3 4.26Å; F1104-W1107 HydrophobicContact CZ-CZ3 4.29Å; F1104-W1107 PolarHBondContact O-N 3.13Å; F1104-W1107 VanDerWaalsContact O-N 3.14Å; F1104-L1108 HydrophobicContact CD1-CD1 4.16Å; F1104-L1108 HydrophobicContact CE1-CD1 3.44Å; F1104-L1108 VanDerWaalsContact CE1-CD1 3.44Å; F1104-L1108 HydrophobicContact CE1-CG 3.91Å; F1104-L1108 HydrophobicContact CZ-CD1 3.97Å; F1104-L1108 HydrophobicContact CZ-CG 4.02Å; F1104-L1108 PolarHBondContact O-N 2.96Å
1105	T	36.6	Very low	33.7	Very low	55 Å²	55	99.8 Å²	99.8	34%	0.337	51%	0.511	S	S	.	.	H	α-helix	trans	-62.4	-36.7	169.8	50.2	0	0	0	0	111.3	V1101 S1102 R1109	V1101-T1105 WeakPolarHBondContact O-CB 3.3Å; V1101-T1105 WeakPolarHBondContact O-CG2 3.4Å; V1101-T1105 PolarHBondContact O-N 2.78Å; V1101-T1105 PolarHBondContact O-OG1 2.91Å; S1102-T1105 PolarHBondContact O-OG1 3.22Å; S1102-T1105 VanDerWaalsContact O-OG1 3.12Å; T1105-R1109 VanDerWaalsContact O-CB 3.31Å; T1105-R1109 WeakPolarHBondContact O-CB 3.48Å; T1105-R1109 PolarHBondContact O-N 2.92Å; T1105-R1109 VanDerWaalsContact O-N 3.12Å
1106	G	36.1	Very low	33.9	Very low	29 Å²	29	97.5 Å²	97.5	30%	0.299	50%	0.499	S	S	.	.	H	α-helix	trans	-60.8	-41.1	169.1	0	0	0	0	0	113.8	S1102 A1103 F1104 R1109 T1110	S1102-G1106 PolarHBondContact O-N 3.47Å; A1103-G1106 CarbonylContact O-C 3.59Å; A1103-G1106 PolarHBondContact O-N 3Å; F1104-G1106 VanDerWaalsContact C-N 3.27Å; F1104-G1106 PolarHBondContact O-N 2.64Å; G1106-R1109 CarbonylContact O-C 3.38Å; G1106-R1109 WeakPolarHBondContact O-CB 3.43Å; G1106-R1109 PolarHBondContact O-N 3.33Å; G1106-T1110 PolarHBondContact O-N 3.44Å; G1106-T1110 VanDerWaalsContact O-N 3.11Å
1107	W	39.5	Very low	34	Very low	122 Å²	122	98.9 Å²	98.9	46%	0.462	50%	0.502	S	S	.	.	H	α-helix	trans	-71.9	-39	178.9	-178.6	76.3	0	0	0	113	M1028 A1103 F1104 R1109 T1110 T1111	M1028-W1107 HydrophobicContact SD-CZ3 4.48Å; A1103-W1107 WeakPolarHBondContact O-CB 3.21Å; A1103-W1107 PolarHBondContact O-N 2.94Å; F1104-W1107 HydrophobicContact CD2-CE3 4.02Å; F1104-W1107 AromaticContact CE2-CE3 3.57Å; F1104-W1107 HydrophobicContact CE2-CE3 3.57Å; F1104-W1107 AromaticContact CE2-CZ3 3.69Å; F1104-W1107 HydrophobicContact CE2-CZ3 3.69Å; F1104-W1107 HydrophobicContact CZ-CE3 4.26Å; F1104-W1107 HydrophobicContact CZ-CZ3 4.29Å; F1104-W1107 PolarHBondContact O-N 3.13Å; F1104-W1107 VanDerWaalsContact O-N 3.14Å; W1107-R1109 VanDerWaalsContact C-N 3.28Å; W1107-R1109 PolarHBondContact O-N 3.29Å; W1107-T1110 PolarHBondContact O-N 3.06Å; W1107-T1110 VanDerWaalsContact O-N 3.16Å; W1107-T1110 PolarHBondContact O-OG1 3.35Å; W1107-T1111 HydrophobicContact CZ2-CG2 4.45Å; W1107-T1111 PolarHBondContact O-N 3.4Å; W1107-T1111 VanDerWaalsContact O-N 3.08Å
1108	L	32.5	Very low	33.9	Very low	15 Å²	15	96 Å²	96	8%	0.079	50%	0.496	C	S	.	.	H	α-helix	trans	-57.1	-45.9	168.8	-82.7	172	0	0	0	110.7	F1104 T1110 T1111 T1112	F1104-L1108 HydrophobicContact CD1-CD1 4.16Å; F1104-L1108 HydrophobicContact CE1-CD1 3.44Å; F1104-L1108 VanDerWaalsContact CE1-CD1 3.44Å; F1104-L1108 HydrophobicContact CE1-CG 3.91Å; F1104-L1108 HydrophobicContact CZ-CD1 3.97Å; F1104-L1108 HydrophobicContact CZ-CG 4.02Å; F1104-L1108 PolarHBondContact O-N 2.96Å; L1108-T1110 PolarHBondContact O-N 3.42Å; L1108-T1111 PolarHBondContact O-N 3.46Å; L1108-T1111 PolarHBondContact O-OG1 3.06Å; L1108-T1111 VanDerWaalsContact O-OG1 3.06Å; L1108-T1112 PolarHBondContact O-N 3.1Å; L1108-T1112 VanDerWaalsContact O-N 3.11Å
1109	R	37.2	Very low	33.7	Very low	153 Å²	153	91.9 Å²	91.9	58%	0.577	48%	0.484	S	S	*	.	H	α-helix	trans	-65.5	-14.4	177.5	-162.7	-175.6	-68.3	172.2	-2.6	114.4	T1105 G1106 W1107	T1105-R1109 VanDerWaalsContact O-CB 3.31Å; T1105-R1109 WeakPolarHBondContact O-CB 3.48Å; T1105-R1109 PolarHBondContact O-N 2.92Å; T1105-R1109 VanDerWaalsContact O-N 3.12Å; G1106-R1109 CarbonylContact O-C 3.38Å; G1106-R1109 WeakPolarHBondContact O-CB 3.43Å; G1106-R1109 PolarHBondContact O-N 3.33Å; W1107-R1109 VanDerWaalsContact C-N 3.28Å; W1107-R1109 PolarHBondContact O-N 3.29Å
1110	T	35.6	Very low	33	Very low	70 Å²	70	97.3 Å²	97.3	43%	0.429	50%	0.503	S	S	.	.	H	α-helix	trans	-87.7	-41.4	165.9	59	0	0	0	0	111.7	G1106 W1107 L1108 T1112 K1113	G1106-T1110 PolarHBondContact O-N 3.44Å; G1106-T1110 VanDerWaalsContact O-N 3.11Å; W1107-T1110 PolarHBondContact O-N 3.06Å; W1107-T1110 VanDerWaalsContact O-N 3.16Å; W1107-T1110 PolarHBondContact O-OG1 3.35Å; L1108-T1110 PolarHBondContact O-N 3.42Å; T1110-T1112 VanDerWaalsContact C-N 3.28Å; T1110-T1112 PolarHBondContact O-N 3.21Å; T1110-K1113 WeakPolarHBondContact O-CB 3.45Å; T1110-K1113 PolarHBondContact O-N 2.99Å
1111	T	31.6	Very low	32.8	Very low	40 Å²	40	96.5 Å²	96.5	25%	0.245	51%	0.506	C	S	.	.	H	α-helix	trans	-67.5	-21.8	-179.9	60.3	0	0	0	0	114.6	K1032 W1107 L1108	K1032-T1111 PolarHBondContact NZ-OG1 2.62Å; W1107-T1111 HydrophobicContact CZ2-CG2 4.45Å; W1107-T1111 PolarHBondContact O-N 3.4Å; W1107-T1111 VanDerWaalsContact O-N 3.08Å; L1108-T1111 PolarHBondContact O-N 3.46Å; L1108-T1111 PolarHBondContact O-OG1 3.06Å; L1108-T1111 VanDerWaalsContact O-OG1 3.06Å
1112	T	33.1	Very low	32.3	Very low	38 Å²	38	98.4 Å²	98.4	23%	0.233	51%	0.512	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.8	-18.4	168.9	59.2	0	0	0	0	113.9	L1108 T1110	L1108-T1112 PolarHBondContact O-N 3.1Å; L1108-T1112 VanDerWaalsContact O-N 3.11Å; T1110-T1112 VanDerWaalsContact C-N 3.28Å; T1110-T1112 PolarHBondContact O-N 3.21Å
1113	K	32.3	Very low	31.9	Very low	140 Å²	140	102.9 Å²	102.9	61%	0.609	53%	0.53	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.5	-32.6	174.2	-74	179.5	177.4	179.1	0	112.4	T1110 L1115 K1116	T1110-K1113 WeakPolarHBondContact O-CB 3.45Å; T1110-K1113 PolarHBondContact O-N 2.99Å; K1113-L1115 PolarHBondContact O-N 3.31Å; K1113-K1116 PolarHBondContact O-N 3.28Å; K1113-K1116 VanDerWaalsContact O-N 3.16Å
1114	D	31.4	Very low	31.5	Very low	126 Å²	126	106.1 Å²	106.1	67%	0.674	54%	0.543	S	S	*	.	G	3₁₀ helix	trans	-69.7	-16.6	177.8	-71.2	-37.6	0	0	0	113.4	K1116	D1114-K1116 VanDerWaalsContact C-N 3.35Å
1115	L	33.7	Very low	31.2	Very low	79 Å²	79	107.9 Å²	107.9	41%	0.414	56%	0.559	S	S	.	*	G	3₁₀ helix	trans	-77.1	-13.1	172.1	-87.6	154	0	0	0	114.5	Q980 K1113 K1117	Q980-L1115 HydrophobicContact CB-CD2 4.46Å; Q980-L1115 HydrophobicContact CG-CD2 4.11Å; K1113-L1115 PolarHBondContact O-N 3.31Å; L1115-K1117 VanDerWaalsContact C-N 3.3Å; L1115-K1117 PolarHBondContact O-N 3.42Å
1116	K	31.2	Very low	31	Very low	142 Å²	142	109 Å²	109	62%	0.617	58%	0.581	S	S	*	*	G	3₁₀ helix	trans	-87.2	17.4	-175	-74.1	178	176.4	158.1	0	115	K1113 D1114 E1266	K1113-K1116 PolarHBondContact O-N 3.28Å; K1113-K1116 VanDerWaalsContact O-N 3.16Å; D1114-K1116 VanDerWaalsContact C-N 3.35Å; K1116-E1266 IonicContact NZ-OE1 3.37Å; K1116-E1266 PolarHBondContact NZ-OE1 3.27Å
1117	K	27.5	Very low	31.3	Very low	187 Å²	187	113 Å²	113	81%	0.813	60%	0.595	S	S	*	*	G	3₁₀ helix	trans	-110.5	22.1	-176.2	-84	-173.8	178.2	172.7	0	116.2	L1115	L1115-K1117 VanDerWaalsContact C-N 3.3Å; L1115-K1117 PolarHBondContact O-N 3.42Å
1118	V	25.5	Very low	31.6	Very low	120 Å²	120	109.3 Å²	109.3	73%	0.727	58%	0.582	S	S	*	*	S	Bend	trans	-134.8	136.6	172.2	-173.9	0	0	0	0	112.2
1119	T	27	Very low	31.7	Very low	97 Å²	97	111.7 Å²	111.7	60%	0.595	60%	0.6	S	S	*	*			trans	60.8	110.2	169.6	41.2	0	0	0	0	119.7
1120	K	25	Very low	31.5	Very low	208 Å²	208	110.4 Å²	110.4	90%	0.904	60%	0.595	S	S	*	*			trans	-77.1	132.3	143.3	-68.7	179.6	176.5	-178.6	0	109.2
1121	P	28.5	Very low	31.1	Very low	118 Å²	118	111.6 Å²	111.6	77%	0.766	60%	0.604	S	S	*	*			trans	-112	156.5	152	34.8	-26.5	0	0	0	111.4
1122	N	24.8	Very low	30.9	Very low	148 Å²	148	117 Å²	117	79%	0.791	63%	0.632	S	S	*	*			trans	-90.6	153.1	177.7	-83.2	-26.1	0	0	0	111.5
1123	I	27.1	Very low	30.5	Very low	157 Å²	157	123.5 Å²	123.5	81%	0.805	66%	0.659	S	S	*	*	S	Bend	trans	82.4	127.7	148.5	-70	159.1	0	0	0	118.7
1124	V	28.1	Very low	30.3	Very low	129 Å²	129	122.2 Å²	122.2	78%	0.782	67%	0.667	S	S	*	*			trans	51.4	91.8	173.8	-162.1	0	0	0	0	119.9
1125	T	31.8	Very low	30	Very low	93 Å²	93	124.1 Å²	124.1	57%	0.571	67%	0.672	S	S	*	*			trans	-143.1	94.5	152.4	38	0	0	0	0	111	S1129	T1125-S1129 PolarHBondContact O-OG 3.03Å
1126	G	32.5	Very low	29.9	Very low	78 Å²	78	127 Å²	127	80%	0.804	69%	0.688	S	S	*	*			trans	-92	-18.2	-166.6	0	0	0	0	0	117.8
1127	L	41.7	Very low	29.5	Very low	112 Å²	112	127.5 Å²	127.5	59%	0.586	70%	0.697	S	S	*	*	S	Bend	trans	-104.3	-31.5	-171.5	-78.2	159.1	0	0	0	114.5	T1050	T1050-L1127 HydrophobicContact CG2-CB 4.49Å; T1050-L1127 HydrophobicContact CG2-CD1 4.19Å
1128	F	45.3	Very low	29.7	Very low	45 Å²	45	125.8 Å²	125.8	20%	0.197	70%	0.695	C	S	.	*	S	Bend	trans	-107.9	-1.1	-172.1	-60.2	-47.9	0	0	0	115.4	E1046 T1050 R1269 L1270 H1273	E1046-F1128 HydrophobicContact CB-CD2 4.2Å; E1046-F1128 HydrophobicContact CB-CE2 4.06Å; E1046-F1128 HydrophobicContact CG-CD2 4.25Å; E1046-F1128 HydrophobicContact CG-CE2 4.19Å; T1050-F1128 HydrophobicContact CG2-CD2 3.99Å; T1050-F1128 HydrophobicContact CG2-CE2 3.51Å; T1050-F1128 HydrophobicContact CG2-CZ 4.27Å; F1128-R1269 HydrophobicContact CD1-CB 3.85Å; F1128-R1269 HydrophobicContact CE1-CB 4.4Å; F1128-R1269 PolarHBondContact O-NH1 3.36Å; F1128-L1270 HydrophobicContact CZ-CD1 4.48Å; F1128-H1273 AromaticContact CE1-CD2 3.66Å; F1128-H1273 AromaticContact CE1-NE2 3.53Å
1129	S	35.8	Very low	29.9	Very low	65 Å²	65	126.3 Å²	126.3	46%	0.455	69%	0.694	S	S	.	*	P	Polyproline II helix	trans	-67.5	133.3	-178.5	-68.2	0	0	0	0	113.1	T1125 R1269	T1125-S1129 PolarHBondContact O-OG 3.03Å; S1129-R1269 PolarHBondContact O-NH1 2.91Å
1130	R	32.3	Very low	30	Very low	126 Å²	126	127.8 Å²	127.8	48%	0.475	70%	0.698	S	S	.	*	P	Polyproline II helix	trans	-74.2	135.9	176.1	-81.8	-176.4	172.1	-157.8	-6.2	111.7	H1265	R1130-H1265 PolarHBondContact NH1-ND1 3.25Å; R1130-H1265 VanDerWaalsContact NH1-ND1 3.12Å; R1130-H1265 PolarHBondContact NH2-O 3.11Å
1131	P	26.7	Very low	30.1	Very low	95 Å²	95	124.4 Å²	124.4	62%	0.617	69%	0.685	S	S	*	*	P	Polyproline II helix	trans	-71.8	128.1	160.7	31	-31	0	0	0	109
1132	N	27.4	Very low	30	Very low	155 Å²	155	124.9 Å²	124.9	83%	0.829	68%	0.681	S	S	*	*	P	Polyproline II helix	trans	-83.2	134	171.7	-69.2	-28.4	0	0	0	109.2
1133	H	25.8	Very low	30.2	Very low	174 Å²	174	127 Å²	127	81%	0.806	69%	0.687	S	S	*	*			trans	-135.2	149.9	172.9	-100.5	-64.5	0	0	0	111.5
1134	S	26.8	Very low	30.1	Very low	112 Å²	112	124.6 Å²	124.6	78%	0.783	68%	0.684	S	S	*	*			trans	72.6	132.9	178.5	75.6	0	0	0	0	114.1
1135	E	26.4	Very low	30.2	Very low	166 Å²	166	125.3 Å²	125.3	78%	0.776	68%	0.681	S	S	*	*			cis	-140.4	163.4	5.1	-58.6	174.4	142	0	0	108.1
1136	N	30.1	Very low	29.9	Very low	140 Å²	140	127 Å²	127	75%	0.749	69%	0.687	S	S	*	*			cis	-158.9	162.2	44.6	-102.9	-63	0	0	0	112.5
1137	L	23	Very low	29.8	Very low	153 Å²	153	131.2 Å²	131.2	80%	0.801	69%	0.69	S	S	*	*			trans	-74	155	171.6	-70.8	76	0	0	0	111.7
1138	I	31.1	Very low	29.2	Very low	150 Å²	150	131.8 Å²	131.8	77%	0.769	70%	0.698	S	S	*	*				174.4	124.1	117.9	-89.8	162.9	0	0	0	111.8
1139	N	31.6	Very low	28.5	Very low	132 Å²	132	134.9 Å²	134.9	71%	0.706	72%	0.721	S	S	*	*			trans	67.3	115.6	155.5	-61.6	0.8	0	0	0	123.6
1140	N	28.7	Very low	28.5	Very low	127 Å²	127	139.8 Å²	139.8	68%	0.679	74%	0.737	S	S	*	*				59.8	141.5	124.2	-59.8	28.3	0	0	0	119.9
1141	E	25.9	Very low	28.6	Very low	137 Å²	137	142.4 Å²	142.4	64%	0.64	75%	0.752	S	S	*	*			cis	-164.5	161.2	1.2	-125.7	173.8	-117.7	0	0	110.5
1142	N	26.4	Very low	29.2	Very low	128 Å²	128	142.5 Å²	142.5	68%	0.684	75%	0.75	S	S	*	*			trans	59	100.6	154.8	-52.5	-33.3	0	0	0	120.3
1143	Q	30.7	Very low	29.8	Very low	194 Å²	194	140.5 Å²	140.5	91%	0.907	74%	0.739	S	S	*	*				-171.7	146	98.9	-99.7	176.8	2.6	0	0	112.8
1144	S	24.1	Very low	30.8	Very low	106 Å²	106	137.6 Å²	137.6	74%	0.741	73%	0.728	S	S	*	*			trans	-73.8	165.4	172.1	43.2	0	0	0	0	110.9
1145	I	30.8	Very low	31.3	Very low	143 Å²	143	140.3 Å²	140.3	73%	0.733	72%	0.722	S	S	*	*				-160.3	145.5	56.9	-76.7	171.2	0	0	0	110.6
1146	D	25.7	Very low	32.3	Very low	130 Å²	130	136.8 Å²	136.8	70%	0.695	71%	0.707	S	S	*	*			trans	12.8	134.2	156.8	-52	-33.6	0	0	0	122.2
1147	L	30.4	Very low	32.9	Very low	165 Å²	165	138.3 Å²	138.3	86%	0.864	70%	0.704	S	S	*	*				-158.5	119.1	105.5	-104.7	158.1	0	0	0	112.2
1148	T	27.2	Very low	34.3	Very low	124 Å²	124	135.5 Å²	135.5	76%	0.761	69%	0.689	S	S	*	*			trans	-100.3	114.4	179.8	37.3	0	0	0	0	110.3
1149	T	32.4	Very low	34.8	Very low	110 Å²	110	135.9 Å²	135.9	68%	0.675	68%	0.682	S	S	*	*			trans	-162.8	-20.9	162.9	0	0	0	0	0	116.9
1150	E	35.2	Very low	35.9	Very low	168 Å²	168	134 Å²	134	79%	0.785	67%	0.67	S	S	*	*	S	Bend	trans	-88.3	-21.2	-174.2	-74.9	-172.3	134.8	0	0	116.3	V1152	E1150-V1152 PolarHBondContact O-N 3.11Å
1151	K	35	Very low	36.6	Very low	182 Å²	182	136.2 Å²	136.2	79%	0.791	67%	0.671	S	S	*	*	H	α-helix	trans	-80.5	-10.4	-173.8	-74.6	-173.8	176.3	178.9	0	115.5
1152	V	38.3	Very low	37.7	Very low	96 Å²	96	134 Å²	134	58%	0.582	66%	0.662	S	S	*	*	H	α-helix	trans	-83.7	-35.3	-179.5	179.5	0	0	0	0	111.6	E1150 Y1155 I1156	E1150-V1152 PolarHBondContact O-N 3.11Å; V1152-Y1155 PolarHBondContact O-N 3.19Å; V1152-I1156 HydrophobicContact CG1-CD1 3.77Å; V1152-I1156 HydrophobicContact CG1-CG1 4.4Å; V1152-I1156 WeakPolarHBondContact O-CG1 3.37Å; V1152-I1156 PolarHBondContact O-N 3.12Å
1153	I	40.8	Very low	38.3	Very low	114 Å²	114	135.3 Å²	135.3	59%	0.585	66%	0.659	S	S	*	*	H	α-helix	trans	-67.7	-41.4	-176.9	-61.3	176	0	0	0	111.3	I1156 Y1157	I1153-I1156 PolarHBondContact O-N 3.5Å; I1153-Y1157 PolarHBondContact O-N 2.97Å
1154	I	45.4	Very low	39.1	Very low	112 Å²	112	131 Å²	131	57%	0.574	64%	0.641	S	S	*	*	H	α-helix	trans	-66.1	-38.9	177.8	-61.7	175	0	0	0	111.3	Y1157 I1158	I1154-Y1157 PolarHBondContact O-N 3.37Å; I1154-I1158 HydrophobicContact CG2-CD1 4.02Å; I1154-I1158 WeakPolarHBondContact O-CG1 3.23Å; I1154-I1158 PolarHBondContact O-N 2.92Å; I1154-I1158 VanDerWaalsContact O-N 3.11Å
1155	Y	37.9	Very low	40	Very low	170 Å²	170	130.8 Å²	130.8	67%	0.667	62%	0.624	S	S	*	*	H	α-helix	trans	-68.7	-37.5	178.3	-119.6	-89.5	0	0	0	112.3	V1152 Y1159	V1152-Y1155 PolarHBondContact O-N 3.19Å; Y1155-Y1159 WeakPolarHBondContact O-CB 3.48Å; Y1155-Y1159 PolarHBondContact O-N 3.11Å
1156	I	47.3	Very low	40.4	Very low	91 Å²	91	128.7 Å²	128.7	47%	0.467	62%	0.615	S	S	.	*	H	α-helix	trans	-65.4	-42.7	174	-69.8	170.3	0	0	0	110.9	V1152 I1153 I1158 Y1159 I1160	V1152-I1156 HydrophobicContact CG1-CD1 3.77Å; V1152-I1156 HydrophobicContact CG1-CG1 4.4Å; V1152-I1156 WeakPolarHBondContact O-CG1 3.37Å; V1152-I1156 PolarHBondContact O-N 3.12Å; I1153-I1156 PolarHBondContact O-N 3.5Å; I1156-I1158 PolarHBondContact O-N 2.99Å; I1156-Y1159 PolarHBondContact O-N 3.23Å; I1156-I1160 HydrophobicContact CG2-CD1 3.66Å; I1156-I1160 HydrophobicContact CG2-CG1 4.33Å; I1156-I1160 WeakPolarHBondContact O-CG1 3.27Å; I1156-I1160 PolarHBondContact O-N 3.46Å
1157	Y	43.9	Very low	41.2	Very low	173 Å²	173	126.6 Å²	126.6	68%	0.678	60%	0.603	S	S	*	*	H	α-helix	trans	-61.2	-42.7	177.7	-116.9	-88.3	0	0	0	112.8	I1153 I1154 Y1161	I1153-Y1157 PolarHBondContact O-N 2.97Å; I1154-Y1157 PolarHBondContact O-N 3.37Å; Y1157-Y1161 WeakPolarHBondContact O-CB 3.5Å; Y1157-Y1161 PolarHBondContact O-N 3.14Å
1158	I	50.5	Low	41.4	Very low	94 Å²	94	125.7 Å²	125.7	48%	0.482	59%	0.592	S	S	.	*	H	α-helix	trans	-66.6	-40.4	176.7	-67.4	168.7	0	0	0	110.9	I1154 I1156 Y1161 I1162	I1154-I1158 HydrophobicContact CG2-CD1 4.02Å; I1154-I1158 WeakPolarHBondContact O-CG1 3.23Å; I1154-I1158 PolarHBondContact O-N 2.92Å; I1154-I1158 VanDerWaalsContact O-N 3.11Å; I1156-I1158 PolarHBondContact O-N 2.99Å; I1158-Y1161 PolarHBondContact O-N 2.95Å; I1158-I1162 HydrophobicContact CG2-CD1 3.9Å; I1158-I1162 WeakPolarHBondContact O-CG1 3.44Å; I1158-I1162 PolarHBondContact O-N 3.37Å; I1158-I1162 VanDerWaalsContact O-N 3.09Å
1159	Y	41.8	Very low	41.9	Very low	157 Å²	157	124.8 Å²	124.8	62%	0.616	58%	0.579	S	S	*	*	H	α-helix	trans	-66.1	-42	178.1	-126.9	-89.9	0	0	0	112.5	Y1155 I1156 I1162 Y1163	Y1155-Y1159 WeakPolarHBondContact O-CB 3.48Å; Y1155-Y1159 PolarHBondContact O-N 3.11Å; I1156-Y1159 PolarHBondContact O-N 3.23Å; Y1159-I1162 PolarHBondContact O-N 2.79Å; Y1159-Y1163 WeakPolarHBondContact O-CB 3.42Å; Y1159-Y1163 PolarHBondContact O-N 2.96Å
1160	I	55.3	Low	42	Very low	92 Å²	92	126.9 Å²	126.9	47%	0.472	58%	0.575	S	S	.	*	H	α-helix	trans	-63.5	-41.8	176.2	-69.5	170.3	0	0	0	110.8	I1156 I1162 Y1163 I1164	I1156-I1160 HydrophobicContact CG2-CD1 3.66Å; I1156-I1160 HydrophobicContact CG2-CG1 4.33Å; I1156-I1160 WeakPolarHBondContact O-CG1 3.27Å; I1156-I1160 PolarHBondContact O-N 3.46Å; I1160-I1162 PolarHBondContact O-N 3.32Å; I1160-Y1163 PolarHBondContact O-N 2.87Å; I1160-I1164 HydrophobicContact CG2-CD1 3.71Å; I1160-I1164 HydrophobicContact CG2-CG1 4.37Å; I1160-I1164 WeakPolarHBondContact O-CG1 3.21Å; I1160-I1164 PolarHBondContact O-N 2.68Å
1161	Y	43.8	Very low	41.9	Very low	175 Å²	175	126.3 Å²	126.3	69%	0.686	57%	0.571	S	S	*	*	H	α-helix	trans	-65.2	-38	179.8	-158	-87.3	0	0	0	112.5	Y1157 I1158 Y1165	Y1157-Y1161 WeakPolarHBondContact O-CB 3.5Å; Y1157-Y1161 PolarHBondContact O-N 3.14Å; I1158-Y1161 PolarHBondContact O-N 2.95Å; Y1161-Y1165 PolarHBondContact O-N 2.82Å
1162	I	48.5	Very low	41.9	Very low	90 Å²	90	123.6 Å²	123.6	46%	0.462	56%	0.563	S	S	.	*	H	α-helix	trans	-67.7	-45.5	173.8	-67.4	167.5	0	0	0	110.5	I1158 Y1159 I1160 I1164 Y1165 D1166	I1158-I1162 HydrophobicContact CG2-CD1 3.9Å; I1158-I1162 WeakPolarHBondContact O-CG1 3.44Å; I1158-I1162 PolarHBondContact O-N 3.37Å; I1158-I1162 VanDerWaalsContact O-N 3.09Å; Y1159-I1162 PolarHBondContact O-N 2.79Å; I1160-I1162 PolarHBondContact O-N 3.32Å; I1162-I1164 PolarHBondContact O-N 3.23Å; I1162-Y1165 PolarHBondContact O-N 3.33Å; I1162-Y1165 VanDerWaalsContact O-N 3.14Å; I1162-D1166 PolarHBondContact O-N 2.91Å
1163	Y	40.2	Very low	41.5	Very low	155 Å²	155	125 Å²	125	61%	0.608	57%	0.568	S	S	*	*	H	α-helix	trans	-65.3	-36.2	-177.4	-143.7	-100.5	0	0	0	113.2	Y1159 I1160 I1167	Y1159-Y1163 WeakPolarHBondContact O-CB 3.42Å; Y1159-Y1163 PolarHBondContact O-N 2.96Å; I1160-Y1163 PolarHBondContact O-N 2.87Å; Y1163-I1167 HydrophobicContact CD1-CD1 3.71Å; Y1163-I1167 HydrophobicContact CD1-CG1 4.4Å; Y1163-I1167 HydrophobicContact CE1-CD1 3.98Å; Y1163-I1167 VanDerWaalsContact O-CG1 3.29Å; Y1163-I1167 WeakPolarHBondContact O-CG1 3.38Å; Y1163-I1167 PolarHBondContact O-N 2.84Å
1164	I	46.8	Very low	40.9	Very low	103 Å²	103	124.7 Å²	124.7	53%	0.528	57%	0.567	S	S	.	*	H	α-helix	trans	-67.5	-37.8	174.1	-69.4	171.6	0	0	0	111	I1160 I1162 I1167 F1168	I1160-I1164 HydrophobicContact CG2-CD1 3.71Å; I1160-I1164 HydrophobicContact CG2-CG1 4.37Å; I1160-I1164 WeakPolarHBondContact O-CG1 3.21Å; I1160-I1164 PolarHBondContact O-N 2.68Å; I1162-I1164 PolarHBondContact O-N 3.23Å; I1164-I1167 PolarHBondContact O-N 2.86Å; I1164-F1168 PolarHBondContact O-N 3.44Å
1165	Y	43.5	Very low	40	Very low	102 Å²	102	128.2 Å²	128.2	40%	0.4	58%	0.58	S	S	.	*	H	α-helix	trans	-67.4	-40.1	178.5	-152.6	-84.9	0	0	0	112	Y1161 I1162 F1168 H1169 N1347	Y1161-Y1165 PolarHBondContact O-N 2.82Å; I1162-Y1165 PolarHBondContact O-N 3.33Å; I1162-Y1165 VanDerWaalsContact O-N 3.14Å; Y1165-F1168 PolarHBondContact O-N 3.17Å; Y1165-H1169 AromaticContact CD1-CD2 3.83Å; Y1165-H1169 AromaticContact CE1-CD2 3.45Å; Y1165-H1169 VanDerWaalsContact CE1-CD2 3.45Å; Y1165-H1169 WeakPolarHBondContact CE1-CD2 3.46Å; Y1165-H1169 AromaticContact CE1-NE2 3.66Å; Y1165-H1169 PolarHBondContact O-N 2.97Å; Y1165-H1169 VanDerWaalsContact O-N 3.12Å; Y1165-N1347 PolarHBondContact OH-ND2 3.35Å
1166	D	38	Very low	39.5	Very low	100 Å²	100	129.3 Å²	129.3	54%	0.535	59%	0.592	S	S	.	*	H	α-helix	trans	-68.1	-38.4	175.1	-74.7	-25	0	0	0	112.2	I1162 H1169 Y1170	I1162-D1166 PolarHBondContact O-N 2.91Å; D1166-H1169 PolarHBondContact O-N 3.25Å; D1166-Y1170 WeakPolarHBondContact O-CB 3.48Å; D1166-Y1170 PolarHBondContact O-N 3.42Å
1167	I	42.9	Very low	38.6	Very low	86 Å²	86	130.8 Å²	130.8	44%	0.441	61%	0.605	S	S	.	*	H	α-helix	trans	-63.3	-41.6	174.4	-72.7	168.9	0	0	0	111.3	Y1163 I1164 Y1170 F1171	Y1163-I1167 HydrophobicContact CD1-CD1 3.71Å; Y1163-I1167 HydrophobicContact CD1-CG1 4.4Å; Y1163-I1167 HydrophobicContact CE1-CD1 3.98Å; Y1163-I1167 VanDerWaalsContact O-CG1 3.29Å; Y1163-I1167 WeakPolarHBondContact O-CG1 3.38Å; Y1163-I1167 PolarHBondContact O-N 2.84Å; I1164-I1167 PolarHBondContact O-N 2.86Å; I1167-Y1170 PolarHBondContact O-N 2.77Å; I1167-F1171 PolarHBondContact O-N 3.23Å
1168	F	35.5	Very low	37.8	Very low	145 Å²	145	128.5 Å²	128.5	64%	0.636	61%	0.605	S	S	*	*	H	α-helix	trans	-66.3	-37	178.2	-128	-90.4	0	0	0	112.4	I1164 Y1165 I1172	I1164-F1168 PolarHBondContact O-N 3.44Å; Y1165-F1168 PolarHBondContact O-N 3.17Å; F1168-I1172 HydrophobicContact CD1-CD1 4.35Å; F1168-I1172 PolarHBondContact O-N 3.49Å
1169	H	36.6	Very low	36.7	Very low	105 Å²	105	132.4 Å²	132.4	49%	0.486	63%	0.626	S	S	.	*	H	α-helix	trans	-74.7	-25.9	175.2	-99.4	-76.3	0	0	0	114.1	Y1165 D1166 N1173	Y1165-H1169 AromaticContact CD1-CD2 3.83Å; Y1165-H1169 AromaticContact CE1-CD2 3.45Å; Y1165-H1169 VanDerWaalsContact CE1-CD2 3.45Å; Y1165-H1169 WeakPolarHBondContact CE1-CD2 3.46Å; Y1165-H1169 AromaticContact CE1-NE2 3.66Å; Y1165-H1169 PolarHBondContact O-N 2.97Å; Y1165-H1169 VanDerWaalsContact O-N 3.12Å; D1166-H1169 PolarHBondContact O-N 3.25Å; H1169-N1173 PolarHBondContact O-ND2 3.47Å
1170	Y	34.4	Very low	36.1	Very low	154 Å²	154	130.2 Å²	130.2	60%	0.604	63%	0.626	S	S	*	*	H	α-helix	trans	-73.9	-39.2	172.5	-166.9	-105.5	0	0	0	111.8	D1166 I1167 I1172 N1173 L1174	D1166-Y1170 WeakPolarHBondContact O-CB 3.48Å; D1166-Y1170 PolarHBondContact O-N 3.42Å; I1167-Y1170 PolarHBondContact O-N 2.77Å; Y1170-I1172 VanDerWaalsContact C-N 3.33Å; Y1170-I1172 PolarHBondContact O-N 3.2Å; Y1170-N1173 PolarHBondContact O-N 3.47Å; Y1170-L1174 HydrophobicContact CE1-CD1 4.22Å; Y1170-L1174 HydrophobicContact CE1-CD2 4.32Å; Y1170-L1174 HydrophobicContact CE2-CD1 4.37Å
1171	F	32.8	Very low	34.8	Very low	156 Å²	156	132 Å²	132	68%	0.684	64%	0.636	S	S	*	*	H	α-helix	trans	-67.6	-28.1	179.2	-114.4	-89.8	0	0	0	114.3	I1167 N1173	I1167-F1171 PolarHBondContact O-N 3.23Å; F1171-N1173 VanDerWaalsContact C-N 3.34Å
1172	I	36.7	Very low	34.1	Very low	125 Å²	125	129.7 Å²	129.7	64%	0.641	65%	0.646	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.9	-14	177.6	-69.3	174.5	0	0	0	112.6	F1168 Y1170	F1168-I1172 HydrophobicContact CD1-CD1 4.35Å; F1168-I1172 PolarHBondContact O-N 3.49Å; Y1170-I1172 VanDerWaalsContact C-N 3.33Å; Y1170-I1172 PolarHBondContact O-N 3.2Å
1173	N	29.2	Very low	33	Very low	126 Å²	126	133.9 Å²	133.9	67%	0.674	66%	0.66	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.2	16.7	178.9	-79.8	-70.8	0	0	0	114.3	H1169 Y1170 F1171	H1169-N1173 PolarHBondContact O-ND2 3.47Å; Y1170-N1173 PolarHBondContact O-N 3.47Å; F1171-N1173 VanDerWaalsContact C-N 3.34Å
1174	L	27.7	Very low	32.4	Very low	108 Å²	108	132 Å²	132	57%	0.565	67%	0.67	S	S	*	*	S	Bend	trans	-120.9	43.8	-178.9	-126.3	83.5	0	0	0	113.5	Y1170	Y1170-L1174 HydrophobicContact CE1-CD1 4.22Å; Y1170-L1174 HydrophobicContact CE1-CD2 4.32Å; Y1170-L1174 HydrophobicContact CE2-CD1 4.37Å
1175	H	27.8	Very low	31.2	Very low	185 Å²	185	135.9 Å²	135.9	86%	0.856	68%	0.683	S	S	*	*	S	Bend	trans	-145.5	37.3	173.1	-109.9	-64.1	0	0	0	114.5
1176	Q	27.4	Very low	30.4	Very low	193 Å²	193	139.2 Å²	139.2	90%	0.902	71%	0.706	S	S	*	*			trans	-149.9	56.4	175.2	-119	169.8	39	0	0	114.2
1177	T	26.8	Very low	29.7	Very low	123 Å²	123	139.4 Å²	139.4	76%	0.755	71%	0.711	S	S	*	*			trans	-154.5	140.2	164.2	53.1	0	0	0	0	106.8
1178	D	27.8	Very low	28.7	Very low	125 Å²	125	144.3 Å²	144.3	67%	0.668	73%	0.734	S	S	*	*			cis	-157.6	146.6	-11.1	-100.1	-40.1	0	0	0	104.3
1179	D	27.7	Very low	28.3	Very low	175 Å²	175	141.2 Å²	141.2	94%	0.936	74%	0.743	S	S	*	*			trans	-144.1	123.3	147.7	-121.8	-23.8	0	0	0	110.4
1180	N	29.6	Very low	27.6	Very low	112 Å²	112	144.7 Å²	144.7	60%	0.599	76%	0.76	S	S	*	*			trans	-119	149.5	-157.5	-108.8	-58.7	0	0	0	111.6
1181	N	27.7	Very low	27	Very low	130 Å²	130	143.8 Å²	143.8	70%	0.695	77%	0.765	S	S	*	*			trans	72.8	115.8	162.4	-58.8	-60.5	0	0	0	119.6
1182	S	29.2	Very low	26.7	Very low	126 Å²	126	143.9 Å²	143.9	88%	0.881	77%	0.773	S	S	*	*				-148.7	153.7	102.1	58.4	0	0	0	0	111.9
1183	K	24.1	Very low	26	Very low	178 Å²	178	142.5 Å²	142.5	77%	0.774	77%	0.774	S	S	*	*			trans	-104.1	139.4	-166.3	-65.3	165.9	176.5	169	0	112.6
1184	S	27.6	Very low	25.9	Very low	115 Å²	115	143.8 Å²	143.8	80%	0.804	78%	0.781	S	S	*	*			trans	-158.2	113.2	137.6	51.9	0	0	0	0	108.4
1185	F	22.3	Very low	25.7	Very low	184 Å²	184	148 Å²	148	81%	0.807	79%	0.791	S	S	*	*				56	104.4	87.9	-87.3	-75.1	0	0	0	115
1186	I	27.2	Very low	25.7	Very low	173 Å²	173	148.3 Å²	148.3	89%	0.887	80%	0.795	S	S	*	*				-161.9	159.3	119.7	-95.8	153.5	0	0	0	108.4
1187	T	23	Very low	25.7	Very low	104 Å²	104	143.6 Å²	143.6	64%	0.638	78%	0.776	S	S	*	*			trans	-135.6	142.5	-162.6	-57.2	0	0	0	0	111.1
1188	M	22.1	Very low	25.5	Very low	189 Å²	189	146.5 Å²	146.5	93%	0.931	78%	0.778	S	S	*	*			trans	61.5	125.6	163.6	-73	-85.1	-178	0	0	118.9
1189	G	25.9	Very low	25.6	Very low	79 Å²	79	145.6 Å²	145.6	81%	0.814	77%	0.774	S	S	*	*			trans	-172.3	127.7	165.4	0	0	0	0	0	110.8
1190	Q	22.6	Very low	25.5	Very low	179 Å²	179	142.3 Å²	142.3	84%	0.836	76%	0.76	S	S	*	*			trans	-86.5	158.9	-173.6	-64.7	168	-72.8	0	0	112.9
1191	N	22.3	Very low	25.2	Very low	134 Å²	134	143.9 Å²	143.9	72%	0.717	77%	0.767	S	S	*	*			trans	60.5	114.3	157.8	-56.1	-4.8	0	0	0	117.6
1192	D	26.4	Very low	25	Very low	158 Å²	158	145.7 Å²	145.7	85%	0.845	78%	0.775	S	S	*	*				-170.4	176.1	82.5	-98.4	-30.8	0	0	0	111.3
1193	S	22.5	Very low	24.7	Very low	97 Å²	97	143.4 Å²	143.4	68%	0.678	77%	0.772	S	S	*	*			trans	-67	147	-173.3	53.2	0	0	0	0	115.2
1194	D	26.9	Very low	24.8	Very low	152 Å²	152	143.1 Å²	143.1	81%	0.813	77%	0.77	S	S	*	*				-154.9	155.6	126.9	-109.9	-29.5	0	0	0	114.6
1195	Y	23.7	Very low	25	Very low	196 Å²	196	140.5 Å²	140.5	77%	0.769	75%	0.745	S	S	*	*			trans	-65.4	130.8	-163.6	-73.5	-110.8	0	0	0	115.6
1196	M	27.7	Very low	25.7	Very low	192 Å²	192	133.8 Å²	133.8	95%	0.946	72%	0.721	S	S	*	*			trans	-132.7	132.9	144.5	-88.9	-63.9	162	0	0	109.8
1197	N	27.5	Very low	25.9	Very low	94 Å²	94	131 Å²	131	50%	0.503	70%	0.704	S	S	.	*			trans	-87.1	145.7	-150.6	-150.2	8.9	0	0	0	113.8	Q1454	N1197-Q1454 PolarHBondContact ND2-O 3Å
1198	K	22.3	Very low	26.4	Very low	185 Å²	185	132.3 Å²	132.3	80%	0.804	70%	0.703	S	S	*	*			trans	-113.2	117.2	168.4	-82.9	-179.5	174.6	175.9	0	108.7
1199	D	29.1	Very low	26.8	Very low	106 Å²	106	125.2 Å²	125.2	57%	0.567	67%	0.674	S	S	*	*			trans	-154.1	108.4	152.9	-88	-39.8	0	0	0	107.1
1200	T	25.4	Very low	27	Very low	106 Å²	106	124.4 Å²	124.4	65%	0.65	66%	0.656	S	S	*	*				83	103.8	63	64.4	0	0	0	0	116.8
1201	I	23.7	Very low	27.2	Very low	144 Å²	144	120 Å²	120	74%	0.738	65%	0.645	S	S	*	*			trans	70.8	102	141.1	-47	155.2	0	0	0	118.8
1202	L	22.9	Very low	27.6	Very low	168 Å²	168	120 Å²	120	88%	0.88	64%	0.636	S	S	*	*				-171.1	153.5	100.8	-117.5	119.1	0	0	0	110.8	K1204	L1202-K1204 PolarHBondContact O-N 3.44Å
1203	G	24.3	Very low	27.8	Very low	78 Å²	78	119.6 Å²	119.6	80%	0.804	62%	0.622	S	S	*	*			trans	-70.5	125.4	-161.8	0	0	0	0	0	116.4
1204	K	26.3	Very low	28.5	Very low	172 Å²	172	117 Å²	117	75%	0.748	60%	0.599	S	S	*	*			trans	-133.4	152.1	157.2	-69.5	-175.2	177.8	-179.4	0	108.7	L1202	L1202-K1204 PolarHBondContact O-N 3.44Å
1205	K	30.2	Very low	28.9	Very low	60 Å²	60	114.3 Å²	114.3	26%	0.261	58%	0.583	S	S	.	*	S	Bend	trans	-60.9	154.1	165.8	-73.1	172.2	175	170.7	0	108.8	D1022 Q1207 D1382	D1022-K1205 IonicContact OD1-NZ 2.81Å; D1022-K1205 PolarHBondContact OD1-NZ 3.29Å; D1022-K1205 IonicContact OD2-NZ 2.86Å; D1022-K1205 PolarHBondContact OD2-NZ 3.46Å; K1205-Q1207 PolarHBondContact O-N 2.8Å; K1205-D1382 WeakPolarHBondContact CB-OD1 3.17Å; K1205-D1382 WeakPolarHBondContact CB-OD2 3.34Å; K1205-D1382 WeakPolarHBondContact CD-OD1 3.29Å
1206	S	37.4	Very low	29.5	Very low	44 Å²	44	110 Å²	110	31%	0.308	57%	0.57	S	S	.	*			trans	-70.5	113.5	-152.6	153.7	0	0	0	0	114.7	H1208 F1214	S1206-H1208 PolarHBondContact O-N 3.33Å; S1206-H1208 PolarHBondContact OG-N 3.03Å; S1206-H1208 PolarHBondContact OG-O 3.28Å; S1206-F1214 VanDerWaalsContact CB-CE2 3.46Å
1207	Q	31.4	Very low	29.9	Very low	115 Å²	115	102.2 Å²	102.2	54%	0.537	54%	0.539	S	S	.	.	S	Bend	trans	-68.2	-12.3	169.5	-76.9	-175.9	-37.4	0	0	114.6	D1017 K1205	D1017-Q1207 PolarHBondContact O-NE2 3.11Å; K1205-Q1207 PolarHBondContact O-N 2.8Å
1208	H	33.2	Very low	30.3	Very low	131 Å²	131	100.8 Å²	100.8	61%	0.606	53%	0.532	S	S	*	.			trans	-135.8	89.1	-180	-66	-37.4	0	0	0	113.4	S1206 S1210	S1206-H1208 PolarHBondContact O-N 3.33Å; S1206-H1208 PolarHBondContact OG-N 3.03Å; S1206-H1208 PolarHBondContact OG-O 3.28Å; H1208-S1210 PolarHBondContact O-N 3.08Å
1209	A	32.1	Very low	30.9	Very low	39 Å²	39	96.9 Å²	96.9	32%	0.322	52%	0.519	S	S	.	.			trans	-66	96.3	166.1	0	0	0	0	0	110.7	R1368 N1372	A1209-R1368 PolarHBondContact O-NE 3.34Å; A1209-N1372 PolarHBondContact O-ND2 3.32Å
1210	S	29.9	Very low	31	Very low	63 Å²	63	95.6 Å²	95.6	44%	0.441	51%	0.511	S	S	.	.	S	Bend	trans	-160.5	9.7	164.6	54.5	0	0	0	0	116.3	H1208 R1368	H1208-S1210 PolarHBondContact O-N 3.08Å; S1210-R1368 PolarHBondContact OG-NH2 3.07Å
1211	S	27	Very low	31.3	Very low	87 Å²	87	94.7 Å²	94.7	61%	0.608	50%	0.502	S	S	*	.	S	Bend	trans	-156.6	-2	176.2	-83.2	0	0	0	0	118.6
1212	Y	30.1	Very low	31.6	Very low	132 Å²	132	92.8 Å²	92.8	52%	0.518	50%	0.499	S	S	.	.			trans	-130.9	137	-171.1	-57.3	-73.2	0	0	0	113.7	L1219	Y1212-L1219 VanDerWaalsContact CB-CD1 3.45Å; Y1212-L1219 HydrophobicContact CD1-CD1 4Å; Y1212-L1219 HydrophobicContact CD1-CG 4.47Å; Y1212-L1219 HydrophobicContact CD2-CD1 4.23Å; Y1212-L1219 HydrophobicContact CG-CD1 3.62Å
1213	R	29.5	Very low	31.9	Very low	150 Å²	150	88.7 Å²	88.7	57%	0.566	49%	0.485	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.1	126.8	170.3	-82	-176.8	175.7	173.3	0.4	109.1	I1220	R1213-I1220 HydrophobicContact CB-CB 4.19Å; R1213-I1220 PolarHBondContact O-N 2.88Å
1214	F	38	Very low	32.3	Very low	42 Å²	42	90.7 Å²	90.7	18%	0.184	48%	0.481	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	126.9	165.1	-73	-83	0	0	0	109.9	S1206 N1218 L1219	S1206-F1214 VanDerWaalsContact CB-CE2 3.46Å; F1214-N1218 WeakPolarHBondContact CA-O 3.45Å; F1214-L1219 HydrophobicContact CE1-CB 4.21Å; F1214-L1219 HydrophobicContact CE1-CD1 3.93Å; F1214-L1219 HydrophobicContact CE2-CD1 4.1Å; F1214-L1219 HydrophobicContact CZ-CD1 3.48Å; F1214-L1219 VanDerWaalsContact CZ-CD1 3.48Å
1215	I	35.2	Very low	32.4	Very low	96 Å²	96	90.4 Å²	90.4	49%	0.492	48%	0.483	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	125.5	167.9	-57.2	-179.7	0	0	0	106.2	G1217 N1218 I1220	I1215-G1217 PolarHBondContact O-N 3.36Å; I1215-G1217 VanDerWaalsContact O-N 3.1Å; I1215-N1218 PolarHBondContact N-O 2.95Å; I1215-N1218 PolarHBondContact O-N 3.34Å; I1215-I1220 HydrophobicContact CD1-CD1 4.28Å
1216	H	35.5	Very low	32.2	Very low	106 Å²	106	94.7 Å²	94.7	49%	0.491	51%	0.509	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.2	33.5	-174.1	-55.8	-65.9	0	0	0	114.6
1217	G	37.7	Very low	31.8	Very low	29 Å²	29	101.8 Å²	101.8	30%	0.299	54%	0.537	S	S	.	.	T	Hydrogen-bonded Turn	trans	80.6	6.5	179.6	0	0	0	0	0	116.1	I1215	I1215-G1217 PolarHBondContact O-N 3.36Å; I1215-G1217 VanDerWaalsContact O-N 3.1Å
1218	N	35	Very low	31.7	Very low	63 Å²	63	101.5 Å²	101.5	34%	0.337	55%	0.547	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	136.9	174.9	-79.2	-12.8	0	0	0	112.8	F1214 I1215 S1251	F1214-N1218 WeakPolarHBondContact CA-O 3.45Å; I1215-N1218 PolarHBondContact N-O 2.95Å; I1215-N1218 PolarHBondContact O-N 3.34Å; N1218-S1251 PolarHBondContact ND2-OG 3.31Å; N1218-S1251 WeakPolarHBondContact OD1-CB 2.94Å; N1218-S1251 PolarHBondContact OD1-OG 3Å
1219	L	34.7	Very low	31.4	Very low	104 Å²	104	102.3 Å²	102.3	55%	0.545	56%	0.562	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-72.2	126.1	172	-166.5	86.5	0	0	0	110.4	Y1212 F1214	Y1212-L1219 VanDerWaalsContact CB-CD1 3.45Å; Y1212-L1219 HydrophobicContact CD1-CD1 4Å; Y1212-L1219 HydrophobicContact CD1-CG 4.47Å; Y1212-L1219 HydrophobicContact CD2-CD1 4.23Å; Y1212-L1219 HydrophobicContact CG-CD1 3.62Å; F1214-L1219 HydrophobicContact CE1-CB 4.21Å; F1214-L1219 HydrophobicContact CE1-CD1 3.93Å; F1214-L1219 HydrophobicContact CE2-CD1 4.1Å; F1214-L1219 HydrophobicContact CZ-CD1 3.48Å; F1214-L1219 VanDerWaalsContact CZ-CD1 3.48Å
1220	I	31	Very low	31.4	Very low	79 Å²	79	104.5 Å²	104.5	41%	0.405	58%	0.58	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-114.9	116.8	168.2	-56.3	175.8	0	0	0	109.2	R1213 I1215	R1213-I1220 HydrophobicContact CB-CB 4.19Å; R1213-I1220 PolarHBondContact O-N 2.88Å; I1215-I1220 HydrophobicContact CD1-CD1 4.28Å
1221	D	31.7	Very low	31.6	Very low	86 Å²	86	108.3 Å²	108.3	46%	0.46	60%	0.595	S	S	.	*			trans	-76.3	124.7	174.9	-175.1	29.2	0	0	0	110.4	S1223	D1221-S1223 PolarHBondContact O-N 2.81Å; D1221-S1223 WeakPolarHBondContact OD2-CB 3.14Å; D1221-S1223 PolarHBondContact OD2-OG 3.18Å
1222	P	30	Very low	31.6	Very low	104 Å²	104	110.8 Å²	110.8	68%	0.675	60%	0.602	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.5	9.4	-175.9	28.6	-35.9	0	0	0	115.1
1223	S	29.2	Very low	31.6	Very low	83 Å²	83	110.2 Å²	110.2	58%	0.58	61%	0.612	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.6	-11.4	-176.7	68.4	0	0	0	0	115.4	D1221	D1221-S1223 PolarHBondContact O-N 2.81Å; D1221-S1223 WeakPolarHBondContact OD2-CB 3.14Å; D1221-S1223 PolarHBondContact OD2-OG 3.18Å
1224	V	33.1	Very low	31.5	Very low	120 Å²	120	109.5 Å²	109.5	73%	0.727	62%	0.619	S	S	*	*	S	Bend	trans	-101.1	4.9	-166.1	-168.4	0	0	0	0	114.4
1225	Q	28.9	Very low	31	Very low	165 Å²	165	113.4 Å²	113.4	77%	0.771	64%	0.643	S	S	*	*	S	Bend	trans	-111.9	64.3	173.6	-74.8	-170	-29.3	0	0	112.6
1226	N	26.5	Very low	31	Very low	151 Å²	151	117.7 Å²	117.7	81%	0.807	66%	0.66	S	S	*	*			trans	-167.2	63.2	161.9	-96.4	-33.1	0	0	0	113.4
1227	Q	29.2	Very low	30.5	Very low	193 Å²	193	117.4 Å²	117.4	90%	0.902	67%	0.67	S	S	*	*			trans	179.2	136.4	163	-101.5	149	85.7	0	0	107.1
1228	S	28.6	Very low	30.2	Very low	108 Å²	108	122.1 Å²	122.1	76%	0.755	70%	0.698	S	S	*	*			cis	-166.5	134.6	-10.9	47.3	0	0	0	0	108.6
1229	T	26.5	Very low	29.8	Very low	149 Å²	149	128.5 Å²	128.5	91%	0.914	72%	0.723	S	S	*	*			trans	-99.3	100.8	169.1	48.7	0	0	0	0	110.8
1230	A	32.7	Very low	29.5	Very low	85 Å²	85	128.7 Å²	128.7	70%	0.702	73%	0.733	S	S	*	*			trans	-177.2	115.9	152.1	0	0	0	0	0	112.3
1231	D	32.5	Very low	29.4	Very low	142 Å²	142	131.7 Å²	131.7	76%	0.759	75%	0.75	S	S	*	*			trans	56.9	103.7	138.7	-60.4	-7	0	0	0	123.3
1232	N	28.4	Very low	29.1	Very low	139 Å²	139	135.1 Å²	135.1	74%	0.743	77%	0.768	S	S	*	*				77.4	139.2	115.4	-71	-35	0	0	0	124.1
1233	T	30.2	Very low	29.1	Very low	121 Å²	121	139.8 Å²	139.8	74%	0.742	78%	0.778	S	S	*	*			trans	85.3	107.8	149.2	45.1	0	0	0	0	122.3
1234	D	27.7	Very low	28.9	Very low	134 Å²	134	142.9 Å²	142.9	72%	0.717	79%	0.793	S	S	*	*				72.4	117.8	128.2	-69	11.4	0	0	0	124.8
1235	N	27.5	Very low	28.6	Very low	125 Å²	125	144.7 Å²	144.7	67%	0.668	80%	0.797	S	S	*	*			trans	58.2	108.9	133.2	-59.9	-42.3	0	0	0	121.1
1236	H	33.6	Very low	28.4	Very low	186 Å²	186	142.5 Å²	142.5	86%	0.861	80%	0.8	S	S	*	*				-178.5	168.1	93	-102.2	-67.8	0	0	0	114.4
1237	S	26.2	Very low	28.5	Very low	100 Å²	100	139.6 Å²	139.6	70%	0.699	79%	0.792	S	S	*	*			trans	-82.6	151.6	-170.3	47.6	0	0	0	0	116.4
1238	S	31	Very low	28.5	Very low	127 Å²	127	135.4 Å²	135.4	89%	0.888	78%	0.784	S	S	*	*				-179.1	167.5	118.2	45.6	0	0	0	0	113
1239	K	27.4	Very low	28.5	Very low	198 Å²	198	135.9 Å²	135.9	86%	0.861	78%	0.778	S	S	*	*			trans	-91.3	149.4	-167.4	-58	164	175.8	175.2	0	112.5
1240	S	26.9	Very low	29	Very low	107 Å²	107	135.3 Å²	135.3	75%	0.748	77%	0.765	S	S	*	*				176.5	140.8	114.6	36.7	0	0	0	0	114.8
1241	D	30	Very low	29.7	Very low	142 Å²	142	132.5 Å²	132.5	76%	0.759	74%	0.74	S	S	*	*			trans	65.1	96.5	140.7	-53.7	-11.2	0	0	0	123.3
1242	N	25.5	Very low	30.6	Very low	158 Å²	158	132.3 Å²	132.3	85%	0.845	74%	0.738	S	S	*	*				42.7	96.4	120.8	-67.5	-18.8	0	0	0	119.5
1243	K	28.8	Very low	32.5	Very low	203 Å²	203	128.6 Å²	128.6	88%	0.883	72%	0.718	S	S	*	*			trans	-148.4	117.9	131.2	-131.5	172.9	-176.2	179.1	0	111.3	I1245	K1243-I1245 PolarHBondContact O-N 3.28Å
1244	T	25.1	Very low	35.1	Very low	148 Å²	148	126.6 Å²	126.6	91%	0.908	70%	0.697	S	S	*	*			trans	-68.3	109.2	179	39.7	0	0	0	0	111.1
1245	I	27.1	Very low	38	Very low	157 Å²	157	121.5 Å²	121.5	81%	0.805	67%	0.671	S	S	*	*			trans	-92.9	115.9	162.2	-63.6	174.5	0	0	0	106.8	K1243 S1247	K1243-I1245 PolarHBondContact O-N 3.28Å; I1245-S1247 PolarHBondContact O-N 3.41Å
1246	S	24.4	Very low	41	Very low	119 Å²	119	116.2 Å²	116.2	83%	0.832	64%	0.641	S	S	*	*			trans	-80	96	173.9	51.7	0	0	0	0	110.1
1247	S	28.2	Very low	43.8	Very low	91 Å²	91	107.3 Å²	107.3	64%	0.636	60%	0.6	S	S	*	*			trans	-75.4	137.1	169.8	49.4	0	0	0	0	111.2	I1245 D1249	I1245-S1247 PolarHBondContact O-N 3.41Å; S1247-D1249 PolarHBondContact O-N 3.11Å
1248	S	29.8	Very low	46.9	Very low	105 Å²	105	103.1 Å²	103.1	73%	0.734	57%	0.569	S	S	*	*			trans	-93.6	82.4	-172.3	54.8	0	0	0	0	113.1	H1250	S1248-H1250 PolarHBondContact O-N 3.33Å; S1248-H1250 VanDerWaalsContact O-N 3.08Å
1249	D	29.5	Very low	49.7	Very low	118 Å²	118	99.1 Å²	99.1	63%	0.631	54%	0.537	S	S	*	.			trans	-82	40	179.4	-73.8	-43.7	0	0	0	114.6	S1247	S1247-D1249 PolarHBondContact O-N 3.11Å
1250	H	37.3	Very low	52.5	Low	137 Å²	137	91.3 Å²	91.3	63%	0.634	50%	0.504	S	S	*	.			trans	-100	1.2	-173.5	-79.3	-40.1	0	0	0	116.3	S1248	S1248-H1250 PolarHBondContact O-N 3.33Å; S1248-H1250 VanDerWaalsContact O-N 3.08Å
1251	S	46.3	Very low	55.4	Low	26 Å²	26	86.6 Å²	86.6	18%	0.182	47%	0.47	C	S	.	.	S	Bend	trans	-93.5	-33.4	-177.2	42.6	0	0	0	0	114.8	N1218 N1253	N1218-S1251 PolarHBondContact ND2-OG 3.31Å; N1218-S1251 WeakPolarHBondContact OD1-CB 2.94Å; N1218-S1251 PolarHBondContact OD1-OG 3Å; S1251-N1253 PolarHBondContact O-N 3.35Å; S1251-N1253 VanDerWaalsContact O-N 3.07Å
1252	L	52.1	Low	58	Low	138 Å²	138	81.9 Å²	81.9	72%	0.723	45%	0.445	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68	-5.7	179.2	-70	173.1	0	0	0	114.6
1253	N	68.9	Low	60.2	Low	60 Å²	60	78.8 Å²	78.8	32%	0.321	43%	0.428	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.9	13.8	-176.2	-83.2	-51	0	0	0	114.2	N1073 M1074 S1251	N1073-N1253 CarbonylContact C-O 3.54Å; N1073-N1253 WeakPolarHBondContact CA-O 3.43Å; N1073-N1253 PolarHBondContact OD1-O 2.86Å; M1074-N1253 HydrophobicContact CB-CB 4.37Å; M1074-N1253 PolarHBondContact N-O 3.46Å; S1251-N1253 PolarHBondContact O-N 3.35Å; S1251-N1253 VanDerWaalsContact O-N 3.07Å
1254	R	84.1	Confident	61.8	Low	80 Å²	80	71.8 Å²	71.8	30%	0.302	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	129.4	179.9	-58.4	-171.7	-175.4	-166.9	0.3	111.5	D1022 Y1071 L1072 Y1256	D1022-R1254 IonicContact OD2-NH1 3.32Å; D1022-R1254 PolarHBondContact OD2-NH1 2.83Å; Y1071-R1254 HydrophobicContact CD2-CB 3.79Å; Y1071-R1254 HydrophobicContact CD2-CG 3.59Å; Y1071-R1254 HydrophobicContact CE2-CB 4.4Å; Y1071-R1254 HydrophobicContact CE2-CG 3.68Å; Y1071-R1254 HydrophobicContact CG-CB 4.33Å; Y1071-R1254 HydrophobicContact CG-CG 4.41Å; L1072-R1254 WeakPolarHBondContact O-CA 3.36Å; R1254-Y1256 HydrophobicContact CB-CE2 3.95Å
1255	V	87.9	Confident	63.4	Low	27 Å²	27	71.9 Å²	71.9	16%	0.164	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	116.1	173.2	178.2	0	0	0	0	108.6	Y1031 Y1071 L1072 M1074	Y1031-V1255 HydrophobicContact CE2-CG1 4.37Å; Y1071-V1255 CarbonylContact C-O 3.29Å; Y1071-V1255 WeakPolarHBondContact CA-O 3.23Å; L1072-V1255 PolarHBondContact N-O 2.75Å; L1072-V1255 PolarHBondContact O-N 3.26Å; M1074-V1255 HydrophobicContact CE-CB 4.31Å; M1074-V1255 HydrophobicContact CE-CG2 3.69Å; M1074-V1255 HydrophobicContact SD-CB 4.36Å; M1074-V1255 HydrophobicContact SD-CG2 3.83Å
1256	Y	91.7	Very high	65.4	Low	13 Å²	13	67.4 Å²	67.4	5%	0.051	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	153.2	-176.3	-65.9	-99.8	0	0	0	112.1	D1022 Y1031 H1068 Y1071 R1254 Y1258 E1259 N1379	D1022-Y1256 PolarHBondContact OD2-OH 2.79Å; Y1031-Y1256 PolarHBondContact OH-O 3.01Å; H1068-Y1256 VanDerWaalsContact O-CD1 3.32Å; H1068-Y1256 WeakPolarHBondContact O-CD1 3.45Å; Y1071-Y1256 HydrophobicContact CD1-CE1 4.1Å; Y1071-Y1256 HydrophobicContact CG-CE1 4.19Å; R1254-Y1256 HydrophobicContact CB-CE2 3.95Å; Y1256-Y1258 VanDerWaalsContact C-N 3.26Å; Y1256-Y1258 VanDerWaalsContact CB-CD1 3.47Å; Y1256-Y1258 HydrophobicContact CD2-CE1 4.39Å; Y1256-Y1258 HydrophobicContact CG-CD1 4.36Å; Y1256-Y1258 HydrophobicContact CG-CE1 4.07Å; Y1256-Y1258 PolarHBondContact O-N 2.98Å; Y1256-E1259 PolarHBondContact N-OE1 3.09Å; Y1256-E1259 WeakPolarHBondContact O-CB 3.36Å; Y1256-E1259 PolarHBondContact O-N 3.24Å; Y1256-N1379 WeakPolarHBondContact CD1-ND2 3.23Å; Y1256-N1379 WeakPolarHBondContact CD2-ND2 3.33Å; Y1256-N1379 WeakPolarHBondContact CE1-ND2 3.2Å; Y1256-N1379 VanDerWaalsContact CE2-ND2 3.3Å; Y1256-N1379 WeakPolarHBondContact CE2-ND2 3.38Å
1257	L	91.7	Very high	68.5	Low	0 Å²	0	64.1 Å²	64.1	0%	0	35%	0.349	C	S	.	.	H	α-helix	trans	-58.2	-35.4	-178	-70.6	175.1	0	0	0	113.4	I1025 Y1031 H1034 I1035 L1038 L1066 H1070 E1259	I1025-L1257 HydrophobicContact CD1-CD1 3.93Å; I1025-L1257 HydrophobicContact CD1-CD2 3.67Å; I1025-L1257 HydrophobicContact CD1-CG 3.79Å; Y1031-L1257 HydrophobicContact CD2-CD2 3.78Å; Y1031-L1257 HydrophobicContact CE2-CD2 3.71Å; Y1031-L1257 HydrophobicContact CE2-CG 4.42Å; H1034-L1257 HydrophobicContact CB-CD1 4.11Å; H1034-L1257 HydrophobicContact CB-CD2 3.65Å; I1035-L1257 HydrophobicContact CD1-CB 4.12Å; I1035-L1257 HydrophobicContact CD1-CD2 3.65Å; I1035-L1257 WeakPolarHBondContact CD1-O 2.93Å; I1035-L1257 HydrophobicContact CG1-CD2 4.08Å; L1038-L1257 HydrophobicContact CD1-CB 4.29Å; L1038-L1257 HydrophobicContact CD1-CD1 3.99Å; L1066-L1257 HydrophobicContact CD2-CD1 4.08Å; L1066-L1257 HydrophobicContact CG-CD1 4.16Å; H1070-L1257 HydrophobicContact CB-CD1 3.67Å; H1070-L1257 HydrophobicContact CB-CG 4.27Å; H1070-L1257 PolarHBondContact O-N 3.49Å; H1070-L1257 VanDerWaalsContact O-N 3.12Å; L1257-E1259 PolarHBondContact O-N 2.98Å
1258	Y	91.8	Very high	71.4	Confident	12 Å²	12	60.3 Å²	60.3	5%	0.047	32%	0.322	C	S	.	.	H	α-helix	trans	-60.9	-30.9	-179.6	81.6	-91.4	0	0	0	113.4	C1067 Y1256 N1260 L1261 I1262 L1337 G1378 N1379	C1067-Y1258 PolarHBondContact O-N 3.14Å; Y1256-Y1258 VanDerWaalsContact C-N 3.26Å; Y1256-Y1258 VanDerWaalsContact CB-CD1 3.47Å; Y1256-Y1258 HydrophobicContact CD2-CE1 4.39Å; Y1256-Y1258 HydrophobicContact CG-CD1 4.36Å; Y1256-Y1258 HydrophobicContact CG-CE1 4.07Å; Y1256-Y1258 PolarHBondContact O-N 2.98Å; Y1258-N1260 VanDerWaalsContact C-N 3.28Å; Y1258-N1260 PolarHBondContact O-N 3.43Å; Y1258-L1261 WeakPolarHBondContact O-CA 3.28Å; Y1258-L1261 WeakPolarHBondContact O-CB 3.25Å; Y1258-L1261 PolarHBondContact O-N 3.41Å; Y1258-I1262 HydrophobicContact CD2-CD1 3.92Å; Y1258-I1262 HydrophobicContact CD2-CG1 4.44Å; Y1258-I1262 HydrophobicContact CE2-CD1 3.85Å; Y1258-I1262 PolarHBondContact O-N 3.14Å; Y1258-I1262 VanDerWaalsContact O-N 3.14Å; Y1258-L1337 HydrophobicContact CD1-CD1 3.36Å; Y1258-L1337 HydrophobicContact CD1-CG 4.18Å; Y1258-L1337 HydrophobicContact CD2-CD1 3.73Å; Y1258-L1337 HydrophobicContact CD2-CG 3.98Å; Y1258-L1337 HydrophobicContact CE1-CD1 3.71Å; Y1258-L1337 HydrophobicContact CE2-CD1 4.07Å; Y1258-L1337 HydrophobicContact CG-CD1 3.37Å; Y1258-L1337 HydrophobicContact CG-CD2 4.38Å; Y1258-L1337 HydrophobicContact CG-CG 3.71Å; Y1258-G1378 WeakPolarHBondContact OH-CA 3.48Å; Y1258-N1379 HydrophobicContact CE1-CB 3.87Å
1259	E	89.7	Confident	74.2	Confident	43 Å²	43	59.5 Å²	59.5	20%	0.201	30%	0.303	C	S	.	.	H	α-helix	trans	-59.8	-40.6	-173.7	-65.3	172.5	-141.3	0	0	111.1	Y1256 L1257 L1261 I1262 D1263	Y1256-E1259 PolarHBondContact N-OE1 3.09Å; Y1256-E1259 WeakPolarHBondContact O-CB 3.36Å; Y1256-E1259 PolarHBondContact O-N 3.24Å; L1257-E1259 PolarHBondContact O-N 2.98Å; E1259-L1261 VanDerWaalsContact C-N 3.3Å; E1259-L1261 PolarHBondContact O-N 3.49Å; E1259-I1262 VanDerWaalsContact O-CG1 3.29Å; E1259-I1262 WeakPolarHBondContact O-CG1 3.31Å; E1259-I1262 PolarHBondContact O-N 3.45Å; E1259-D1263 WeakPolarHBondContact O-CB 3.31Å; E1259-D1263 PolarHBondContact O-N 3.5Å
1260	N	86.7	Confident	77.2	Confident	33 Å²	33	53.9 Å²	53.9	18%	0.176	27%	0.273	C	S	.	.	H	α-helix	trans	-75.8	-16	176.9	-82.5	-119	0	0	0	113.5	Y1031 I1035 Y1258	Y1031-N1260 PolarHBondContact OH-ND2 3.5Å; I1035-N1260 HydrophobicContact CD1-CB 3.84Å; I1035-N1260 HydrophobicContact CG1-CB 4.19Å; I1035-N1260 HydrophobicContact CG2-CB 4.37Å; Y1258-N1260 VanDerWaalsContact C-N 3.28Å; Y1258-N1260 PolarHBondContact O-N 3.43Å
1261	L	86.3	Confident	79.9	Confident	8 Å²	8	47.5 Å²	47.5	4%	0.042	24%	0.243	C	C	.	.	H	α-helix	trans	-88.7	-16.1	177	-61.4	176.4	0	0	0	113	I1035 L1038 Q1039 I1042 C1067 Y1258 E1259 R1267 M1338	I1035-L1261 HydrophobicContact CG2-CD2 4.49Å; L1038-L1261 HydrophobicContact CB-CD1 4.49Å; L1038-L1261 HydrophobicContact CD1-CD1 4.31Å; Q1039-L1261 HydrophobicContact CG-CD2 4.18Å; I1042-L1261 HydrophobicContact CD1-CD1 4.21Å; I1042-L1261 HydrophobicContact CD1-CD2 3.97Å; C1067-L1261 VanDerWaalsContact SG-CD1 3.5Å; Y1258-L1261 WeakPolarHBondContact O-CA 3.28Å; Y1258-L1261 WeakPolarHBondContact O-CB 3.25Å; Y1258-L1261 PolarHBondContact O-N 3.41Å; E1259-L1261 VanDerWaalsContact C-N 3.3Å; E1259-L1261 PolarHBondContact O-N 3.49Å; L1261-R1267 VanDerWaalsContact O-CA 3.27Å; L1261-R1267 WeakPolarHBondContact O-CA 3.38Å; L1261-R1267 WeakPolarHBondContact O-CB 3.47Å; L1261-M1338 HydrophobicContact CB-CE 3.99Å
1262	I	85.4	Confident	82	Confident	44 Å²	44	50.3 Å²	50.3	23%	0.226	26%	0.256	C	S	.	.	H	α-helix	trans	-99.3	-20	173.5	61.9	173	0	0	0	113.2	Y1258 E1259 G1264 M1338	Y1258-I1262 HydrophobicContact CD2-CD1 3.92Å; Y1258-I1262 HydrophobicContact CD2-CG1 4.44Å; Y1258-I1262 HydrophobicContact CE2-CD1 3.85Å; Y1258-I1262 PolarHBondContact O-N 3.14Å; Y1258-I1262 VanDerWaalsContact O-N 3.14Å; E1259-I1262 VanDerWaalsContact O-CG1 3.29Å; E1259-I1262 WeakPolarHBondContact O-CG1 3.31Å; E1259-I1262 PolarHBondContact O-N 3.45Å; I1262-G1264 PolarHBondContact O-N 2.79Å; I1262-M1338 HydrophobicContact CG2-CE 4.03Å; I1262-M1338 HydrophobicContact CG2-SD 4.46Å
1263	D	72.5	Confident	83.9	Confident	92 Å²	92	47.9 Å²	47.9	49%	0.492	24%	0.241	S	C	.	.	S	Bend	trans	-76.4	121.4	-171.3	-122.3	8	0	0	0	114.5	E1259 H1265	E1259-D1263 WeakPolarHBondContact O-CB 3.31Å; E1259-D1263 PolarHBondContact O-N 3.5Å; D1263-H1265 PolarHBondContact O-N 2.84Å
1264	G	62.1	Low	85	Confident	57 Å²	57	46.6 Å²	46.6	59%	0.588	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	66.7	-122.6	164.1	0	0	0	0	0	115.9	I1262	I1262-G1264 PolarHBondContact O-N 2.79Å
1265	H	58.2	Low	85.3	Confident	149 Å²	149	46 Å²	46	69%	0.69	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.6	-0.5	-167.7	-80.6	-3.5	0	0	0	115	R1130 D1263	R1130-H1265 PolarHBondContact NH1-ND1 3.25Å; R1130-H1265 VanDerWaalsContact NH1-ND1 3.12Å; R1130-H1265 PolarHBondContact NH2-O 3.11Å; D1263-H1265 PolarHBondContact O-N 2.84Å
1266	E	69.6	Low	85.6	Confident	63 Å²	63	45 Å²	45	29%	0.294	23%	0.228	S	C	.	.			trans	-113.4	-6.7	-167.9	-59.1	-171.8	-176.4	0	0	113.9	Q1039 K1116 S1268	Q1039-E1266 PolarHBondContact NE2-OE2 3.03Å; Q1039-E1266 VanDerWaalsContact NE2-OE2 3.08Å; K1116-E1266 IonicContact NZ-OE1 3.37Å; K1116-E1266 PolarHBondContact NZ-OE1 3.27Å; E1266-S1268 PolarHBondContact O-N 2.98Å
1267	R	88	Confident	85.7	Confident	50 Å²	50	44.3 Å²	44.3	19%	0.189	23%	0.225	C	C	.	.			trans	-60.3	120.8	170.7	-173.3	177.4	172.8	-84.1	13.2	110.6	L1261 D1272 M1338 N1339	L1261-R1267 VanDerWaalsContact O-CA 3.27Å; L1261-R1267 WeakPolarHBondContact O-CA 3.38Å; L1261-R1267 WeakPolarHBondContact O-CB 3.47Å; R1267-D1272 IonicContact CZ-OD1 2.7Å; R1267-D1272 VanDerWaalsContact CZ-OD1 3.26Å; R1267-D1272 IonicContact CZ-OD2 3.2Å; R1267-D1272 IonicContact NH1-OD1 3.79Å; R1267-D1272 PolarHBondContact NH1-OD1 3.41Å; R1267-D1272 IonicContact NH1-OD2 2.67Å; R1267-D1272 PolarHBondContact NH1-OD2 2.88Å; R1267-D1272 IonicContact NH2-OD1 2.72Å; R1267-D1272 PolarHBondContact NH2-OD1 2.71Å; R1267-M1338 PolarHBondContact NE-O 3.11Å; R1267-M1338 PolarHBondContact NH2-O 3.09Å; R1267-M1338 VanDerWaalsContact NH2-O 3.1Å; R1267-N1339 PolarHBondContact NH2-O 3.37Å; R1267-N1339 VanDerWaalsContact NH2-O 3.09Å
1268	S	90	Very high	85.8	Confident	12 Å²	12	46.5 Å²	46.5	8%	0.084	24%	0.235	C	C	.	.			trans	-62.6	146.2	174.7	176.3	0	0	0	0	111.1	E1046 E1266 L1270	E1046-S1268 WeakPolarHBondContact OE1-CB 3.48Å; E1046-S1268 PolarHBondContact OE1-OG 3.37Å; E1266-S1268 PolarHBondContact O-N 2.98Å; S1268-L1270 WeakPolarHBondContact OG-CB 3.25Å; S1268-L1270 PolarHBondContact OG-N 3.12Å
1269	R	88.4	Confident	85.9	Confident	87 Å²	87	47.2 Å²	47.2	33%	0.328	24%	0.24	S	C	.	.	S	Bend	trans	-73.2	-16.5	170.1	-74.5	180	171.7	170.7	-0	112.8	F1128 S1129 W1271 D1272 H1273	F1128-R1269 HydrophobicContact CD1-CB 3.85Å; F1128-R1269 HydrophobicContact CE1-CB 4.4Å; F1128-R1269 PolarHBondContact O-NH1 3.36Å; S1129-R1269 PolarHBondContact O-NH1 2.91Å; R1269-W1271 PolarHBondContact O-N 2.67Å; R1269-D1272 WeakPolarHBondContact O-CB 3.21Å; R1269-D1272 PolarHBondContact O-N 2.72Å; R1269-H1273 PolarHBondContact O-CD2 3.26Å
1270	L	92.2	Very high	86.1	Confident	1 Å²	1	45.2 Å²	45.2	1%	0.005	23%	0.231	C	C	.	.	G	3₁₀ helix	trans	-50.2	-42.9	179.5	-179.1	62.8	0	0	0	111.8	L1045 E1046 C1049 F1128 S1268 D1272 H1273 F1276	L1045-L1270 HydrophobicContact CB-CD2 3.75Å; E1046-L1270 HydrophobicContact CG-CB 4.21Å; E1046-L1270 HydrophobicContact CG-CD2 4.29Å; C1049-L1270 HydrophobicContact CB-CD1 4.01Å; F1128-L1270 HydrophobicContact CZ-CD1 4.48Å; S1268-L1270 WeakPolarHBondContact OG-CB 3.25Å; S1268-L1270 PolarHBondContact OG-N 3.12Å; L1270-D1272 PolarHBondContact O-N 3.07Å; L1270-D1272 VanDerWaalsContact O-N 3.17Å; L1270-H1273 PolarHBondContact O-N 3.26Å; L1270-H1273 VanDerWaalsContact O-N 3.13Å; L1270-F1276 HydrophobicContact CD1-CB 3.86Å; L1270-F1276 HydrophobicContact CD1-CD1 4.32Å; L1270-F1276 HydrophobicContact CD1-CD2 3.75Å; L1270-F1276 HydrophobicContact CD1-CE2 4.43Å; L1270-F1276 HydrophobicContact CD1-CG 3.67Å; L1270-F1276 HydrophobicContact CD2-CD2 4.14Å; L1270-F1276 HydrophobicContact CD2-CE2 3.99Å; L1270-F1276 HydrophobicContact CD2-CG 4.46Å; L1270-F1276 HydrophobicContact CD2-CZ 4.21Å; L1270-F1276 HydrophobicContact CG-CB 4.45Å; L1270-F1276 HydrophobicContact CG-CD1 4.01Å; L1270-F1276 HydrophobicContact CG-CD2 3.99Å; L1270-F1276 HydrophobicContact CG-CE1 4.32Å; L1270-F1276 HydrophobicContact CG-CE2 4.27Å; L1270-F1276 HydrophobicContact CG-CG 3.84Å; L1270-F1276 HydrophobicContact CG-CZ 4.44Å
1271	W	93.6	Very high	86.6	Confident	2 Å²	2	43.7 Å²	43.7	1%	0.008	22%	0.222	C	C	.	.	G	3₁₀ helix	trans	-62.9	-20.4	-179.3	-43.8	130	0	0	0	114	I1042 L1063 L1064 R1269 F1276 W1277 M1338 V1340	I1042-W1271 HydrophobicContact CD1-CZ2 3.9Å; I1042-W1271 HydrophobicContact CG1-CH2 4.23Å; I1042-W1271 HydrophobicContact CG1-CZ2 3.88Å; I1042-W1271 HydrophobicContact CG2-CZ2 4.21Å; L1063-W1271 HydrophobicContact CD2-CH2 4.29Å; L1064-W1271 HydrophobicContact CD2-CH2 4.46Å; L1064-W1271 HydrophobicContact CD2-CZ3 4.43Å; R1269-W1271 PolarHBondContact O-N 2.67Å; W1271-F1276 HydrophobicContact CE3-CD1 4.28Å; W1271-F1276 AromaticContact CE3-CE1 3.57Å; W1271-F1276 HydrophobicContact CE3-CE1 3.57Å; W1271-F1276 HydrophobicContact CE3-CZ 4.16Å; W1271-F1276 AromaticContact CZ3-CE1 3.52Å; W1271-F1276 HydrophobicContact CZ3-CE1 3.52Å; W1271-F1276 AromaticContact CZ3-CZ 3.62Å; W1271-F1276 HydrophobicContact CZ3-CZ 3.62Å; W1271-W1277 HydrophobicContact CB-CZ2 4.25Å; W1271-W1277 HydrophobicContact CE3-CH2 4.22Å; W1271-W1277 AromaticContact CE3-CZ2 3.9Å; W1271-W1277 HydrophobicContact CE3-CZ2 3.9Å; W1271-W1277 PolarHBondContact O-NE1 3.31Å; W1271-M1338 HydrophobicContact CB-CB 4.36Å; W1271-M1338 HydrophobicContact CD2-CB 4.37Å; W1271-M1338 HydrophobicContact CD2-CE 4.2Å; W1271-M1338 HydrophobicContact CD2-CG 4.32Å; W1271-M1338 HydrophobicContact CG-CB 4.15Å; W1271-M1338 HydrophobicContact CG-CE 4.38Å; W1271-M1338 HydrophobicContact CZ2-CE 3.95Å; W1271-M1338 VanDerWaalsContact NE1-CE 3.33Å; W1271-V1340 WeakPolarHBondContact O-CG2 3.49Å
1272	D	91.6	Very high	86.9	Confident	85 Å²	85	43.7 Å²	43.7	46%	0.455	22%	0.222	S	C	.	.	G	3₁₀ helix	trans	-88.7	-8.6	-179.8	-55.7	-42.4	0	0	0	112.7	R1267 R1269 L1270	R1267-D1272 IonicContact CZ-OD1 2.7Å; R1267-D1272 VanDerWaalsContact CZ-OD1 3.26Å; R1267-D1272 IonicContact CZ-OD2 3.2Å; R1267-D1272 IonicContact NH1-OD1 3.79Å; R1267-D1272 PolarHBondContact NH1-OD1 3.41Å; R1267-D1272 IonicContact NH1-OD2 2.67Å; R1267-D1272 PolarHBondContact NH1-OD2 2.88Å; R1267-D1272 IonicContact NH2-OD1 2.72Å; R1267-D1272 PolarHBondContact NH2-OD1 2.71Å; R1269-D1272 WeakPolarHBondContact O-CB 3.21Å; R1269-D1272 PolarHBondContact O-N 2.72Å; L1270-D1272 PolarHBondContact O-N 3.07Å; L1270-D1272 VanDerWaalsContact O-N 3.17Å
1273	H	91.8	Very high	87.3	Confident	87 Å²	87	42.1 Å²	42.1	40%	0.403	21%	0.214	S	C	.	.			trans	-92.1	110.8	176.4	-72.3	-89	0	0	0	111.1	F1128 R1269 L1270 Q1275 F1276	F1128-H1273 AromaticContact CE1-CD2 3.66Å; F1128-H1273 AromaticContact CE1-NE2 3.53Å; R1269-H1273 PolarHBondContact O-CD2 3.26Å; L1270-H1273 PolarHBondContact O-N 3.26Å; L1270-H1273 VanDerWaalsContact O-N 3.13Å; H1273-Q1275 VanDerWaalsContact C-N 3.27Å; H1273-Q1275 PolarHBondContact O-N 3.01Å; H1273-F1276 WeakPolarHBondContact O-CB 3.43Å; H1273-F1276 PolarHBondContact O-N 3.31Å; H1273-F1276 VanDerWaalsContact O-N 3.1Å
1274	M	92.8	Very high	88.4	Confident	33 Å²	33	38.3 Å²	38.3	16%	0.163	19%	0.194	C	C	.	.	H	α-helix	trans	-61.9	-31.5	178.8	-71.9	-56.3	98.5	0	0	113.7	F1276 W1277 E1278 M1335 V1340 I1344 H1348	M1274-F1276 PolarHBondContact O-N 3.28Å; M1274-W1277 VanDerWaalsContact CE-CD1 3.41Å; M1274-W1277 HydrophobicContact CE-CG 4.41Å; M1274-W1277 PolarHBondContact O-N 2.94Å; M1274-E1278 PolarHBondContact O-N 2.7Å; M1274-M1335 HydrophobicContact CE-CE 3.92Å; M1274-M1335 HydrophobicContact SD-CE 3.56Å; M1274-M1335 VanDerWaalsContact SD-CE 3.56Å; M1274-V1340 HydrophobicContact CE-CG1 3.58Å; M1274-I1344 HydrophobicContact CE-CG2 4.42Å; M1274-I1344 HydrophobicContact CG-CG2 3.66Å; M1274-I1344 HydrophobicContact SD-CG2 3.93Å; M1274-H1348 HydrophobicContact CG-CB 4.36Å; M1274-H1348 PolarHBondContact O-NE2 3.48Å; M1274-H1348 HydrophobicContact SD-CB 3.9Å
1275	Q	89.2	Confident	90	Very high	67 Å²	67	35.6 Å²	35.6	31%	0.313	17%	0.166	S	C	.	.	H	α-helix	trans	-57.8	-33.5	175.2	-165.8	65	49.9	0	0	112.5	F473 H1273 D1279	F473-Q1275 HydrophobicContact CD2-CG 4Å; F473-Q1275 HydrophobicContact CE2-CG 4.06Å; H1273-Q1275 VanDerWaalsContact C-N 3.27Å; H1273-Q1275 PolarHBondContact O-N 3.01Å; Q1275-D1279 PolarHBondContact NE2-OD1 3.34Å; Q1275-D1279 WeakPolarHBondContact O-CB 3.45Å; Q1275-D1279 VanDerWaalsContact O-CG 3.25Å; Q1275-D1279 PolarHBondContact O-N 3.25Å
1276	F	93.4	Very high	91.7	Very high	6 Å²	6	29.3 Å²	29.3	3%	0.026	14%	0.14	C	C	.	.	H	α-helix	trans	-64.6	-42.9	175.3	158.1	-101.2	0	0	0	111.5	C1049 L1057 A1060 L1270 W1271 H1273 M1274 T1280	C1049-F1276 VanDerWaalsContact SG-CD2 3.53Å; L1057-F1276 HydrophobicContact CD1-CD2 4.21Å; L1057-F1276 HydrophobicContact CD2-CD2 4.42Å; L1057-F1276 HydrophobicContact CD2-CE2 4.39Å; A1060-F1276 HydrophobicContact CB-CE2 4.07Å; A1060-F1276 HydrophobicContact CB-CZ 3.84Å; L1270-F1276 HydrophobicContact CD1-CB 3.86Å; L1270-F1276 HydrophobicContact CD1-CD1 4.32Å; L1270-F1276 HydrophobicContact CD1-CD2 3.75Å; L1270-F1276 HydrophobicContact CD1-CE2 4.43Å; L1270-F1276 HydrophobicContact CD1-CG 3.67Å; L1270-F1276 HydrophobicContact CD2-CD2 4.14Å; L1270-F1276 HydrophobicContact CD2-CE2 3.99Å; L1270-F1276 HydrophobicContact CD2-CG 4.46Å; L1270-F1276 HydrophobicContact CD2-CZ 4.21Å; L1270-F1276 HydrophobicContact CG-CB 4.45Å; L1270-F1276 HydrophobicContact CG-CD1 4.01Å; L1270-F1276 HydrophobicContact CG-CD2 3.99Å; L1270-F1276 HydrophobicContact CG-CE1 4.32Å; L1270-F1276 HydrophobicContact CG-CE2 4.27Å; L1270-F1276 HydrophobicContact CG-CG 3.84Å; L1270-F1276 HydrophobicContact CG-CZ 4.44Å; W1271-F1276 HydrophobicContact CE3-CD1 4.28Å; W1271-F1276 AromaticContact CE3-CE1 3.57Å; W1271-F1276 HydrophobicContact CE3-CE1 3.57Å; W1271-F1276 HydrophobicContact CE3-CZ 4.16Å; W1271-F1276 AromaticContact CZ3-CE1 3.52Å; W1271-F1276 HydrophobicContact CZ3-CE1 3.52Å; W1271-F1276 AromaticContact CZ3-CZ 3.62Å; W1271-F1276 HydrophobicContact CZ3-CZ 3.62Å; H1273-F1276 WeakPolarHBondContact O-CB 3.43Å; H1273-F1276 PolarHBondContact O-N 3.31Å; H1273-F1276 VanDerWaalsContact O-N 3.1Å; M1274-F1276 PolarHBondContact O-N 3.28Å; F1276-T1280 WeakPolarHBondContact CD2-OG1 3.38Å; F1276-T1280 WeakPolarHBondContact CE2-OG1 3.25Å; F1276-T1280 WeakPolarHBondContact CZ-OG1 3.41Å; F1276-T1280 WeakPolarHBondContact O-CB 3.49Å; F1276-T1280 PolarHBondContact O-N 3.19Å; F1276-T1280 PolarHBondContact O-OG1 3.05Å
1277	W	95.4	Very high	92.8	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-68.8	-38.2	179.2	-64.6	100.7	0	0	0	112	L1064 W1271 M1274 F1281 L1331 M1335 M1338 V1340	L1064-W1277 HydrophobicContact CD1-CH2 4.23Å; L1064-W1277 HydrophobicContact CD1-CZ3 3.9Å; W1271-W1277 HydrophobicContact CB-CZ2 4.25Å; W1271-W1277 HydrophobicContact CE3-CH2 4.22Å; W1271-W1277 AromaticContact CE3-CZ2 3.9Å; W1271-W1277 HydrophobicContact CE3-CZ2 3.9Å; W1271-W1277 PolarHBondContact O-NE1 3.31Å; M1274-W1277 VanDerWaalsContact CE-CD1 3.41Å; M1274-W1277 HydrophobicContact CE-CG 4.41Å; M1274-W1277 PolarHBondContact O-N 2.94Å; W1277-F1281 WeakPolarHBondContact O-CB 3.37Å; W1277-F1281 PolarHBondContact O-N 2.82Å; W1277-L1331 HydrophobicContact CE3-CD1 3.84Å; W1277-L1331 HydrophobicContact CE3-CG 4.33Å; W1277-L1331 HydrophobicContact CZ3-CD1 4.47Å; W1277-M1335 HydrophobicContact CB-CE 4.42Å; W1277-M1335 HydrophobicContact CB-SD 4.47Å; W1277-M1335 HydrophobicContact CD2-CE 4.42Å; W1277-M1335 HydrophobicContact CD2-CG 3.55Å; W1277-M1335 HydrophobicContact CD2-SD 4.27Å; W1277-M1335 HydrophobicContact CE3-CG 3.47Å; W1277-M1335 VanDerWaalsContact CE3-CG 3.47Å; W1277-M1335 HydrophobicContact CE3-SD 4.39Å; W1277-M1335 HydrophobicContact CG-CE 4.1Å; W1277-M1335 HydrophobicContact CG-CG 4.18Å; W1277-M1335 HydrophobicContact CG-SD 4.33Å; W1277-M1335 HydrophobicContact CH2-CB 4.49Å; W1277-M1335 HydrophobicContact CH2-CG 3.95Å; W1277-M1335 HydrophobicContact CZ2-CG 4.02Å; W1277-M1335 HydrophobicContact CZ3-CG 3.68Å; W1277-M1338 HydrophobicContact CH2-CB 4.31Å; W1277-M1338 HydrophobicContact CH2-CG 4.18Å; W1277-M1338 HydrophobicContact CZ2-CB 4.28Å; W1277-V1340 HydrophobicContact CZ2-CG2 3.74Å
1278	E	93.7	Very high	93	Very high	45 Å²	45	27.7 Å²	27.7	21%	0.21	14%	0.135	C	C	.	.	H	α-helix	trans	-64.5	-52.8	174.8	-176.7	154.1	-150.3	0	0	112.5	M1274 T1280 F1281 F1282 H1348 L1352	M1274-E1278 PolarHBondContact O-N 2.7Å; E1278-T1280 VanDerWaalsContact C-N 3.31Å; E1278-T1280 PolarHBondContact O-N 3.42Å; E1278-F1281 WeakPolarHBondContact O-CB 3.45Å; E1278-F1281 PolarHBondContact O-N 2.96Å; E1278-F1281 VanDerWaalsContact O-N 3.17Å; E1278-F1282 HydrophobicContact CG-CD2 3.94Å; E1278-F1282 HydrophobicContact CG-CE2 3.24Å; E1278-F1282 HydrophobicContact CG-CZ 3.65Å; E1278-F1282 WeakPolarHBondContact O-CD2 3.4Å; E1278-F1282 WeakPolarHBondContact O-CG 3.3Å; E1278-F1282 PolarHBondContact O-N 3.5Å; E1278-H1348 IonicContact OE2-CE1 2.82Å; E1278-L1352 HydrophobicContact CG-CD2 4.09Å
1279	D	92.3	Very high	93.2	Very high	28 Å²	28	27.1 Å²	27.1	15%	0.15	13%	0.131	C	C	.	.	H	α-helix	trans	-65	-36.3	177.8	-66.6	-18.7	0	0	0	111.3	L1057 Q1275 F1282 D1283	L1057-D1279 HydrophobicContact CD1-CB 3.65Å; Q1275-D1279 PolarHBondContact NE2-OD1 3.34Å; Q1275-D1279 WeakPolarHBondContact O-CB 3.45Å; Q1275-D1279 VanDerWaalsContact O-CG 3.25Å; Q1275-D1279 PolarHBondContact O-N 3.25Å; D1279-F1282 PolarHBondContact O-N 2.89Å; D1279-D1283 WeakPolarHBondContact O-CB 3.17Å; D1279-D1283 PolarHBondContact O-N 3.04Å
1280	T	94.8	Very high	93.3	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-61	-44.4	172.5	-64.2	0	0	0	0	111.2	A1060 M1061 F1276 E1278 T1284 L1331	A1060-T1280 HydrophobicContact CB-CG2 3.92Å; M1061-T1280 HydrophobicContact CG-CG2 4Å; M1061-T1280 HydrophobicContact SD-CG2 4.16Å; F1276-T1280 WeakPolarHBondContact CD2-OG1 3.38Å; F1276-T1280 WeakPolarHBondContact CE2-OG1 3.25Å; F1276-T1280 WeakPolarHBondContact CZ-OG1 3.41Å; F1276-T1280 WeakPolarHBondContact O-CB 3.49Å; F1276-T1280 PolarHBondContact O-N 3.19Å; F1276-T1280 PolarHBondContact O-OG1 3.05Å; E1278-T1280 VanDerWaalsContact C-N 3.31Å; E1278-T1280 PolarHBondContact O-N 3.42Å; T1280-T1284 VanDerWaalsContact O-CB 3.26Å; T1280-T1284 WeakPolarHBondContact O-CB 3.15Å; T1280-T1284 PolarHBondContact O-N 3.49Å; T1280-T1284 PolarHBondContact O-OG1 3.29Å; T1280-L1331 HydrophobicContact CG2-CD1 4.47Å
1281	F	96.3	Very high	93.2	Very high	1 Å²	1	32.5 Å²	32.5	0%	0.004	17%	0.165	C	C	.	.	H	α-helix	trans	-61.9	-49.6	176.9	172.9	-108	0	0	0	111.2	W1277 E1278 T1284 V1285 L1324 C1327 L1328 L1331 L1352 C1356	W1277-F1281 WeakPolarHBondContact O-CB 3.37Å; W1277-F1281 PolarHBondContact O-N 2.82Å; E1278-F1281 WeakPolarHBondContact O-CB 3.45Å; E1278-F1281 PolarHBondContact O-N 2.96Å; E1278-F1281 VanDerWaalsContact O-N 3.17Å; F1281-T1284 PolarHBondContact O-N 2.92Å; F1281-V1285 HydrophobicContact CD2-CG2 4.03Å; F1281-V1285 HydrophobicContact CE1-CG2 4.23Å; F1281-V1285 HydrophobicContact CE2-CG2 3.55Å; F1281-V1285 HydrophobicContact CZ-CG2 3.66Å; F1281-V1285 WeakPolarHBondContact O-CG2 3.44Å; F1281-V1285 PolarHBondContact O-N 3.05Å; F1281-L1324 HydrophobicContact CZ-CD2 4.25Å; F1281-C1327 HydrophobicContact CD2-CB 4.15Å; F1281-C1327 HydrophobicContact CE2-CB 3.72Å; F1281-L1328 HydrophobicContact CD1-CD2 4.4Å; F1281-L1328 HydrophobicContact CD2-CD2 3.82Å; F1281-L1328 HydrophobicContact CD2-CG 4.25Å; F1281-L1328 HydrophobicContact CE1-CD2 4.15Å; F1281-L1328 HydrophobicContact CE2-CB 4.48Å; F1281-L1328 HydrophobicContact CE2-CD2 3.53Å; F1281-L1328 HydrophobicContact CE2-CG 3.51Å; F1281-L1328 HydrophobicContact CG-CD2 4.26Å; F1281-L1328 HydrophobicContact CZ-CD1 4.3Å; F1281-L1328 HydrophobicContact CZ-CD2 3.71Å; F1281-L1328 HydrophobicContact CZ-CG 3.71Å; F1281-L1331 HydrophobicContact CB-CD1 4.42Å; F1281-L1331 HydrophobicContact CB-CD2 3.93Å; F1281-L1331 HydrophobicContact CD2-CD2 4.37Å; F1281-L1331 HydrophobicContact CG-CD2 4.35Å; F1281-L1352 HydrophobicContact CD1-CD1 4.34Å; F1281-L1352 HydrophobicContact CD1-CD2 4.37Å; F1281-C1356 VanDerWaalsContact CE1-SG 3.6Å; F1281-C1356 VanDerWaalsContact CZ-SG 3.6Å
1282	F	94.2	Very high	92.9	Very high	9 Å²	9	35.5 Å²	35.5	4%	0.039	18%	0.181	C	C	.	.	H	α-helix	trans	-64.4	-41.9	-179.5	-60.3	-35.6	0	0	0	113.4	R458 I460 A469 E1278 D1279 A1286 L1352	R458-F1282 HydrophobicContact CB-CB 4.22Å; R458-F1282 HydrophobicContact CG-CB 4.18Å; I460-F1282 HydrophobicContact CD1-CD1 4.06Å; I460-F1282 HydrophobicContact CD1-CE1 3.65Å; I460-F1282 HydrophobicContact CD1-CZ 4.48Å; I460-F1282 HydrophobicContact CG1-CD1 4.24Å; I460-F1282 HydrophobicContact CG1-CE1 4.33Å; A469-F1282 HydrophobicContact CB-CB 4.2Å; A469-F1282 HydrophobicContact CB-CD1 3.61Å; A469-F1282 HydrophobicContact CB-CD2 3.43Å; A469-F1282 VanDerWaalsContact CB-CD2 3.43Å; A469-F1282 HydrophobicContact CB-CE1 3.72Å; A469-F1282 HydrophobicContact CB-CE2 3.5Å; A469-F1282 VanDerWaalsContact CB-CE2 3.5Å; A469-F1282 HydrophobicContact CB-CG 3.48Å; A469-F1282 VanDerWaalsContact CB-CG 3.48Å; A469-F1282 HydrophobicContact CB-CZ 3.67Å; E1278-F1282 HydrophobicContact CG-CD2 3.94Å; E1278-F1282 HydrophobicContact CG-CE2 3.24Å; E1278-F1282 HydrophobicContact CG-CZ 3.65Å; E1278-F1282 WeakPolarHBondContact O-CD2 3.4Å; E1278-F1282 WeakPolarHBondContact O-CG 3.3Å; E1278-F1282 PolarHBondContact O-N 3.5Å; D1279-F1282 PolarHBondContact O-N 2.89Å; F1282-A1286 WeakPolarHBondContact O-CB 3.49Å; F1282-A1286 PolarHBondContact O-N 2.99Å; F1282-L1352 HydrophobicContact CE1-CD2 4.1Å; F1282-L1352 HydrophobicContact CZ-CD2 3.94Å
1283	D	93.9	Very high	92.7	Very high	10 Å²	10	32.8 Å²	32.8	5%	0.053	17%	0.173	C	C	.	.	H	α-helix	trans	-66.7	-37.2	175.3	-81.2	-9.7	0	0	0	111.9	R458 Q471 G1055 G1056 L1057 A1058 D1279 Q1287	R458-D1283 IonicContact CZ-OD1 2.86Å; R458-D1283 IonicContact NE-OD1 2.95Å; R458-D1283 PolarHBondContact NE-OD1 3.27Å; R458-D1283 IonicContact NH2-OD1 3.84Å; Q471-D1283 PolarHBondContact NE2-OD1 3Å; Q471-D1283 VanDerWaalsContact NE2-OD1 3.11Å; G1055-D1283 VanDerWaalsContact CA-CG 3.44Å; G1055-D1283 WeakPolarHBondContact CA-OD1 3.09Å; G1055-D1283 WeakPolarHBondContact CA-OD2 3.31Å; G1056-D1283 PolarHBondContact N-OD2 3.1Å; L1057-D1283 PolarHBondContact N-OD2 2.76Å; A1058-D1283 HydrophobicContact CB-CB 4.22Å; D1279-D1283 WeakPolarHBondContact O-CB 3.17Å; D1279-D1283 PolarHBondContact O-N 3.04Å; D1283-Q1287 WeakPolarHBondContact O-CB 3.26Å; D1283-Q1287 PolarHBondContact O-N 2.95Å
1284	T	95.4	Very high	92.5	Very high	12 Å²	12	30.4 Å²	30.4	7%	0.074	16%	0.163	C	C	.	.	H	α-helix	trans	-66.6	-45.8	176.8	-57.3	0	0	0	0	111.2	M1061 T1280 F1281 Q1287 E1288	M1061-T1284 HydrophobicContact CB-CG2 4.44Å; M1061-T1284 HydrophobicContact CE-CG2 4.44Å; M1061-T1284 HydrophobicContact CG-CG2 3.84Å; M1061-T1284 WeakPolarHBondContact CG-OG1 3.44Å; T1280-T1284 VanDerWaalsContact O-CB 3.26Å; T1280-T1284 WeakPolarHBondContact O-CB 3.15Å; T1280-T1284 PolarHBondContact O-N 3.49Å; T1280-T1284 PolarHBondContact O-OG1 3.29Å; F1281-T1284 PolarHBondContact O-N 2.92Å; T1284-Q1287 PolarHBondContact O-N 2.94Å; T1284-E1288 PolarHBondContact O-N 3.37Å
1285	V	95.7	Very high	92.1	Very high	1 Å²	1	30.8 Å²	30.8	1%	0.006	17%	0.166	C	C	.	.	H	α-helix	trans	-60.5	-47.6	176.8	168	0	0	0	0	110.2	F1281 Q1287 E1288 R1289 L1324 C1327	F1281-V1285 HydrophobicContact CD2-CG2 4.03Å; F1281-V1285 HydrophobicContact CE1-CG2 4.23Å; F1281-V1285 HydrophobicContact CE2-CG2 3.55Å; F1281-V1285 HydrophobicContact CZ-CG2 3.66Å; F1281-V1285 WeakPolarHBondContact O-CG2 3.44Å; F1281-V1285 PolarHBondContact O-N 3.05Å; V1285-Q1287 VanDerWaalsContact C-N 3.32Å; V1285-Q1287 PolarHBondContact O-N 3.3Å; V1285-E1288 PolarHBondContact O-N 3.21Å; V1285-R1289 HydrophobicContact CG1-CG 4.22Å; V1285-R1289 WeakPolarHBondContact O-CB 3.36Å; V1285-R1289 WeakPolarHBondContact O-CG 3.25Å; V1285-R1289 PolarHBondContact O-N 3.13Å; V1285-L1324 HydrophobicContact CB-CD2 4.46Å; V1285-L1324 HydrophobicContact CG1-CD2 3.66Å; V1285-L1324 HydrophobicContact CG2-CD2 3.87Å; V1285-C1327 HydrophobicContact CG2-CB 4.14Å
1286	A	93	Very high	91.9	Very high	17 Å²	17	31.8 Å²	31.8	14%	0.14	17%	0.171	C	C	.	.	H	α-helix	trans	-61.8	-38.1	176.9	0	0	0	0	0	112.8	R458 F1282 R1289 D1290	R458-A1286 HydrophobicContact CB-CB 4.43Å; F1282-A1286 WeakPolarHBondContact O-CB 3.49Å; F1282-A1286 PolarHBondContact O-N 2.99Å; A1286-R1289 PolarHBondContact O-N 2.93Å; A1286-D1290 WeakPolarHBondContact O-CB 3.44Å; A1286-D1290 PolarHBondContact O-N 3.42Å
1287	Q	92.8	Very high	91.6	Very high	63 Å²	63	33.6 Å²	33.6	29%	0.294	19%	0.186	S	C	.	.	H	α-helix	trans	-64.9	-47.5	175	176.1	169.1	80.2	0	0	112.2	A1058 D1283 T1284 V1285 R1289 D1290 I1291	A1058-Q1287 HydrophobicContact CB-CB 4.22Å; D1283-Q1287 WeakPolarHBondContact O-CB 3.26Å; D1283-Q1287 PolarHBondContact O-N 2.95Å; T1284-Q1287 PolarHBondContact O-N 2.94Å; V1285-Q1287 VanDerWaalsContact C-N 3.32Å; V1285-Q1287 PolarHBondContact O-N 3.3Å; Q1287-R1289 VanDerWaalsContact C-N 3.34Å; Q1287-R1289 PolarHBondContact O-N 3.33Å; Q1287-D1290 PolarHBondContact O-N 3.28Å; Q1287-I1291 HydrophobicContact CG-CD1 3.83Å; Q1287-I1291 WeakPolarHBondContact O-CD1 3.49Å; Q1287-I1291 WeakPolarHBondContact O-CG1 3.39Å; Q1287-I1291 PolarHBondContact O-N 3.31Å; Q1287-I1291 VanDerWaalsContact O-N 3.09Å
1288	E	93.3	Very high	91.1	Very high	15 Å²	15	35 Å²	35	7%	0.07	20%	0.196	C	C	.	.	H	α-helix	trans	-62.4	-41.4	176.4	-73.6	-80.5	108.4	0	0	111.2	T1284 V1285 I1291 L1292 L1323 P1386 M1387 T1388	T1284-E1288 PolarHBondContact O-N 3.37Å; V1285-E1288 PolarHBondContact O-N 3.21Å; E1288-I1291 PolarHBondContact O-N 3.19Å; E1288-L1292 WeakPolarHBondContact O-CB 3.39Å; E1288-L1292 WeakPolarHBondContact O-CD1 3.45Å; E1288-L1292 WeakPolarHBondContact O-CG 3.46Å; E1288-L1292 PolarHBondContact O-N 2.97Å; E1288-L1323 HydrophobicContact CB-CD1 3.59Å; E1288-L1323 HydrophobicContact CB-CD2 4.49Å; E1288-L1323 HydrophobicContact CG-CD1 4.03Å; E1288-P1386 WeakPolarHBondContact OE2-CB 3.31Å; E1288-M1387 PolarHBondContact OE2-N 3.36Å; E1288-T1388 HydrophobicContact CB-CG2 4.44Å; E1288-T1388 HydrophobicContact CG-CG2 4.47Å; E1288-T1388 WeakPolarHBondContact OE1-CB 3.3Å; E1288-T1388 WeakPolarHBondContact OE1-CG2 3.38Å; E1288-T1388 PolarHBondContact OE1-OG1 2.96Å; E1288-T1388 WeakPolarHBondContact OE2-CG2 3.36Å; E1288-T1388 PolarHBondContact OE2-N 3.33Å; E1288-T1388 PolarHBondContact OE2-OG1 2.95Å
1289	R	92.6	Very high	90.5	Very high	1 Å²	1	35.5 Å²	35.5	0%	0.004	20%	0.202	C	C	.	.	H	α-helix	trans	-62.1	-45.3	177.4	-72.3	175.3	67.1	77.1	19.4	112.7	T459 I460 V1285 A1286 Q1287 L1292 G1293 L1294 D1295 E1320 L1323	T459-R1289 VanDerWaalsContact O-CD 3.26Å; T459-R1289 WeakPolarHBondContact O-CD 3.34Å; I460-R1289 PolarHBondContact O-NH1 3.33Å; V1285-R1289 HydrophobicContact CG1-CG 4.22Å; V1285-R1289 WeakPolarHBondContact O-CB 3.36Å; V1285-R1289 WeakPolarHBondContact O-CG 3.25Å; V1285-R1289 PolarHBondContact O-N 3.13Å; A1286-R1289 PolarHBondContact O-N 2.93Å; Q1287-R1289 VanDerWaalsContact C-N 3.34Å; Q1287-R1289 PolarHBondContact O-N 3.33Å; R1289-L1292 CarbonylContact O-C 3.58Å; R1289-L1292 PolarHBondContact O-N 2.86Å; R1289-G1293 PolarHBondContact O-N 3.49Å; R1289-L1294 HydrophobicContact CB-CB 4.17Å; R1289-L1294 HydrophobicContact CG-CB 4.41Å; R1289-L1294 HydrophobicContact CG-CD1 4.41Å; R1289-L1294 PolarHBondContact NH2-O 3.43Å; R1289-L1294 PolarHBondContact O-N 3.07Å; R1289-D1295 WeakPolarHBondContact CB-OD2 3.48Å; R1289-D1295 IonicContact CZ-OD1 2.84Å; R1289-D1295 IonicContact NE-OD1 3.8Å; R1289-D1295 PolarHBondContact NE-OD1 2.88Å; R1289-D1295 IonicContact NE-OD2 2.74Å; R1289-D1295 PolarHBondContact NE-OD2 2.77Å; R1289-D1295 IonicContact NH2-OD1 2.64Å; R1289-D1295 PolarHBondContact NH2-OD1 3.07Å; R1289-E1320 IonicContact CZ-OE1 3.25Å; R1289-E1320 IonicContact NH1-OE1 3.53Å; R1289-E1320 PolarHBondContact NH1-OE1 2.77Å; R1289-E1320 IonicContact NH2-OE1 3.9Å; R1289-L1323 HydrophobicContact CG-CD2 3.69Å
1290	D	90.6	Very high	90.3	Very high	94 Å²	94	40.5 Å²	40.5	50%	0.503	22%	0.224	S	C	.	.	H	α-helix	trans	-63	-43	176.4	-176.6	45.6	0	0	0	111.6	A1286 Q1287 L1292 G1293	A1286-D1290 WeakPolarHBondContact O-CB 3.44Å; A1286-D1290 PolarHBondContact O-N 3.42Å; Q1287-D1290 PolarHBondContact O-N 3.28Å; D1290-L1292 VanDerWaalsContact C-N 3.3Å; D1290-L1292 PolarHBondContact O-N 2.84Å; D1290-G1293 PolarHBondContact O-N 3.29Å; D1290-G1293 VanDerWaalsContact O-N 3.07Å
1291	I	90.1	Very high	90	Very high	106 Å²	106	42.3 Å²	42.3	54%	0.544	23%	0.233	S	C	.	.	H	α-helix	trans	-62.4	-38.1	176	-64.4	163.2	0	0	0	111.5	Q1287 E1288 G1293 T1388	Q1287-I1291 HydrophobicContact CG-CD1 3.83Å; Q1287-I1291 WeakPolarHBondContact O-CD1 3.49Å; Q1287-I1291 WeakPolarHBondContact O-CG1 3.39Å; Q1287-I1291 PolarHBondContact O-N 3.31Å; Q1287-I1291 VanDerWaalsContact O-N 3.09Å; E1288-I1291 PolarHBondContact O-N 3.19Å; I1291-G1293 VanDerWaalsContact C-N 3.27Å; I1291-G1293 PolarHBondContact O-N 3.33Å; I1291-T1388 HydrophobicContact CB-CG2 3.75Å; I1291-T1388 HydrophobicContact CD1-CG2 4.23Å; I1291-T1388 HydrophobicContact CG2-CG2 3.46Å; I1291-T1388 VanDerWaalsContact CG2-CG2 3.46Å
1292	L	88.6	Confident	89.5	Confident	65 Å²	65	43.2 Å²	43.2	34%	0.34	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.3	-5.7	176.6	-66.5	168.3	0	0	0	113.6	E1288 R1289 D1290 L1294 L1323 M1387 T1388	E1288-L1292 WeakPolarHBondContact O-CB 3.39Å; E1288-L1292 WeakPolarHBondContact O-CD1 3.45Å; E1288-L1292 WeakPolarHBondContact O-CG 3.46Å; E1288-L1292 PolarHBondContact O-N 2.97Å; R1289-L1292 CarbonylContact O-C 3.58Å; R1289-L1292 PolarHBondContact O-N 2.86Å; D1290-L1292 VanDerWaalsContact C-N 3.3Å; D1290-L1292 PolarHBondContact O-N 2.84Å; L1292-L1294 VanDerWaalsContact C-N 3.28Å; L1292-L1294 HydrophobicContact CB-CD1 4.04Å; L1292-L1294 HydrophobicContact CB-CG 3.9Å; L1292-L1294 HydrophobicContact CD1-CD1 4.04Å; L1292-L1294 PolarHBondContact O-N 2.77Å; L1292-L1323 HydrophobicContact CD1-CD1 4.44Å; L1292-L1323 HydrophobicContact CD1-CD2 4.29Å; L1292-M1387 HydrophobicContact CD1-CB 4.14Å; L1292-M1387 HydrophobicContact CD1-CG 3.74Å; L1292-M1387 HydrophobicContact CD1-SD 3.61Å; L1292-M1387 HydrophobicContact CD2-CG 4.24Å; L1292-T1388 HydrophobicContact CD2-CG2 4.24Å; L1292-T1388 HydrophobicContact CG-CG2 4.02Å
1293	G	87.8	Confident	89.1	Confident	29 Å²	29	47 Å²	47	30%	0.299	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	74.6	9.6	-176.7	0	0	0	0	0	115.1	R1289 D1290 I1291 D1295 Q1296	R1289-G1293 PolarHBondContact O-N 3.49Å; D1290-G1293 PolarHBondContact O-N 3.29Å; D1290-G1293 VanDerWaalsContact O-N 3.07Å; I1291-G1293 VanDerWaalsContact C-N 3.27Å; I1291-G1293 PolarHBondContact O-N 3.33Å; G1293-D1295 PolarHBondContact O-N 2.96Å; G1293-Q1296 PolarHBondContact O-N 3.44Å
1294	L	87	Confident	88.8	Confident	37 Å²	37	52.3 Å²	52.3	19%	0.194	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.2	-6.2	-174.6	-65	175.3	0	0	0	114.6	L462 R1289 L1292 M1301 L1323	L462-L1294 WeakPolarHBondContact CD1-O 3.48Å; R1289-L1294 HydrophobicContact CB-CB 4.17Å; R1289-L1294 HydrophobicContact CG-CB 4.41Å; R1289-L1294 HydrophobicContact CG-CD1 4.41Å; R1289-L1294 PolarHBondContact NH2-O 3.43Å; R1289-L1294 PolarHBondContact O-N 3.07Å; L1292-L1294 VanDerWaalsContact C-N 3.28Å; L1292-L1294 HydrophobicContact CB-CD1 4.04Å; L1292-L1294 HydrophobicContact CB-CG 3.9Å; L1292-L1294 HydrophobicContact CD1-CD1 4.04Å; L1292-L1294 PolarHBondContact O-N 2.77Å; L1294-M1301 WeakPolarHBondContact O-CE 3.21Å; L1294-L1323 HydrophobicContact CD1-CD2 4.2Å
1295	D	84.2	Confident	88.6	Confident	41 Å²	41	52.7 Å²	52.7	22%	0.219	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	-112.1	7.1	176.7	-67.6	-32.2	0	0	0	113	R1289 G1293	R1289-D1295 WeakPolarHBondContact CB-OD2 3.48Å; R1289-D1295 IonicContact CZ-OD1 2.84Å; R1289-D1295 IonicContact NE-OD1 3.8Å; R1289-D1295 PolarHBondContact NE-OD1 2.88Å; R1289-D1295 IonicContact NE-OD2 2.74Å; R1289-D1295 PolarHBondContact NE-OD2 2.77Å; R1289-D1295 IonicContact NH2-OD1 2.64Å; R1289-D1295 PolarHBondContact NH2-OD1 3.07Å; G1293-D1295 PolarHBondContact O-N 2.96Å
1296	Q	84.8	Confident	88.1	Confident	88 Å²	88	54 Å²	54	41%	0.411	29%	0.292	S	S	.	.	S	Bend	trans	-83.1	117.5	176.1	-59.2	-64.5	-36.1	0	0	110.3	G1293 M1301	G1293-Q1296 PolarHBondContact O-N 3.44Å; Q1296-M1301 WeakPolarHBondContact O-CE 3.42Å
1297	A	86.3	Confident	87.8	Confident	43 Å²	43	60 Å²	60	36%	0.355	32%	0.322	S	S	.	.	S	Bend	trans	53.6	62	-178.7	0	0	0	0	0	114.5	T1299 E1300 M1301	A1297-T1299 PolarHBondContact O-N 3.25Å; A1297-T1299 VanDerWaalsContact O-N 3.16Å; A1297-E1300 HydrophobicContact CB-CB 4.14Å; A1297-E1300 HydrophobicContact CB-CG 4.14Å; A1297-E1300 PolarHBondContact O-N 3.36Å; A1297-E1300 VanDerWaalsContact O-N 3.14Å; A1297-M1301 PolarHBondContact O-N 3.24Å; A1297-M1301 VanDerWaalsContact O-N 3.14Å
1298	P	85.5	Confident	87.6	Confident	30 Å²	30	59.2 Å²	59.2	20%	0.195	32%	0.319	C	S	.	.	H	α-helix	trans	-58	-32.8	-176.1	24.7	-35.1	0	0	0	113.6	L462 L1302	L462-P1298 HydrophobicContact CD1-CB 3.99Å; L462-P1298 HydrophobicContact CD2-CB 3.93Å; P1298-L1302 WeakPolarHBondContact O-CD1 3.42Å; P1298-L1302 VanDerWaalsContact O-CG 3.23Å; P1298-L1302 WeakPolarHBondContact O-CG 3.36Å; P1298-L1302 PolarHBondContact O-N 2.84Å
1299	T	82.4	Confident	87.3	Confident	56 Å²	56	61.5 Å²	61.5	34%	0.344	33%	0.331	S	S	.	.	H	α-helix	trans	-63.3	-47.6	177	-44.6	0	0	0	0	112	Y504 A1297 L1302 E1303	Y504-T1299 HydrophobicContact CD2-CG2 3.79Å; Y504-T1299 HydrophobicContact CE2-CG2 3.59Å; A1297-T1299 PolarHBondContact O-N 3.25Å; A1297-T1299 VanDerWaalsContact O-N 3.16Å; T1299-L1302 PolarHBondContact O-N 3.25Å; T1299-E1303 WeakPolarHBondContact O-CG 3.41Å; T1299-E1303 PolarHBondContact O-N 2.82Å; T1299-E1303 VanDerWaalsContact O-N 3.14Å
1300	E	86.5	Confident	87	Confident	132 Å²	132	67 Å²	67	62%	0.617	37%	0.365	S	S	*	.	H	α-helix	trans	-64.3	-44.6	178.8	-63.8	174.5	-168.9	0	0	110.3	A1297 L1302 E1303 E1304	A1297-E1300 HydrophobicContact CB-CB 4.14Å; A1297-E1300 HydrophobicContact CB-CG 4.14Å; A1297-E1300 PolarHBondContact O-N 3.36Å; A1297-E1300 VanDerWaalsContact O-N 3.14Å; E1300-L1302 VanDerWaalsContact C-N 3.32Å; E1300-L1302 PolarHBondContact O-N 3.01Å; E1300-E1303 PolarHBondContact O-N 3.17Å; E1300-E1303 VanDerWaalsContact O-N 3.17Å; E1300-E1304 WeakPolarHBondContact O-CG 3.48Å; E1300-E1304 PolarHBondContact O-N 3.22Å
1301	M	88.5	Confident	86.7	Confident	38 Å²	38	62.6 Å²	62.6	19%	0.187	34%	0.341	C	S	.	.	H	α-helix	trans	-61.2	-35.4	177.1	-75.6	-167.7	-65.7	0	0	113.7	L462 F463 L1294 Q1296 A1297 F1305	L462-M1301 HydrophobicContact CD1-CE 3.66Å; F463-M1301 WeakPolarHBondContact CE1-O 3.47Å; F463-M1301 HydrophobicContact CZ-CB 4.09Å; L1294-M1301 WeakPolarHBondContact O-CE 3.21Å; Q1296-M1301 WeakPolarHBondContact O-CE 3.42Å; A1297-M1301 PolarHBondContact O-N 3.24Å; A1297-M1301 VanDerWaalsContact O-N 3.14Å; M1301-F1305 VanDerWaalsContact O-CB 3.27Å; M1301-F1305 WeakPolarHBondContact O-CB 3.29Å; M1301-F1305 PolarHBondContact O-N 2.96Å
1302	L	87.5	Confident	86.6	Confident	20 Å²	20	61.6 Å²	61.6	11%	0.105	33%	0.334	C	S	.	.	H	α-helix	trans	-70.2	-37.8	175	-73.7	164.1	0	0	0	112.2	L462 F463 P466 Y504 P1298 T1299 E1300 F1305 A1306	L462-L1302 WeakPolarHBondContact O-CD2 3.44Å; F463-L1302 HydrophobicContact CD1-CD2 4.18Å; F463-L1302 HydrophobicContact CE1-CD2 4.11Å; P466-L1302 HydrophobicContact CG-CD1 3.75Å; P466-L1302 HydrophobicContact CG-CD2 4.09Å; Y504-L1302 HydrophobicContact CD2-CB 4.14Å; Y504-L1302 HydrophobicContact CD2-CD1 3.53Å; Y504-L1302 HydrophobicContact CD2-CG 4.49Å; Y504-L1302 HydrophobicContact CE2-CB 4.15Å; Y504-L1302 HydrophobicContact CE2-CD1 4.37Å; Y504-L1302 HydrophobicContact CG-CD1 3.76Å; P1298-L1302 WeakPolarHBondContact O-CD1 3.42Å; P1298-L1302 VanDerWaalsContact O-CG 3.23Å; P1298-L1302 WeakPolarHBondContact O-CG 3.36Å; P1298-L1302 PolarHBondContact O-N 2.84Å; T1299-L1302 PolarHBondContact O-N 3.25Å; E1300-L1302 VanDerWaalsContact C-N 3.32Å; E1300-L1302 PolarHBondContact O-N 3.01Å; L1302-F1305 PolarHBondContact O-N 3.44Å; L1302-A1306 PolarHBondContact O-N 3.44Å
1303	E	85.4	Confident	86.7	Confident	88 Å²	88	61 Å²	61	41%	0.411	33%	0.329	S	S	.	.	H	α-helix	trans	-70.3	-41.1	175.6	-70	-177	178	0	0	112	Y504 T1299 E1300 A1306 N1307	Y504-E1303 HydrophobicContact CE2-CG 4.28Å; Y504-E1303 PolarHBondContact OH-OE1 2.99Å; T1299-E1303 WeakPolarHBondContact O-CG 3.41Å; T1299-E1303 PolarHBondContact O-N 2.82Å; T1299-E1303 VanDerWaalsContact O-N 3.14Å; E1300-E1303 PolarHBondContact O-N 3.17Å; E1300-E1303 VanDerWaalsContact O-N 3.17Å; E1303-A1306 PolarHBondContact O-N 3.13Å; E1303-N1307 PolarHBondContact O-N 3.26Å; E1303-N1307 PolarHBondContact O-ND2 3.47Å
1304	E	87.9	Confident	86.8	Confident	123 Å²	123	62.6 Å²	62.6	58%	0.575	33%	0.326	S	S	*	.	H	α-helix	trans	-58.9	-49	170	-73.1	-170.2	166.8	0	0	110.8	E1300 A1306 N1307 M1308	E1300-E1304 WeakPolarHBondContact O-CG 3.48Å; E1300-E1304 PolarHBondContact O-N 3.22Å; E1304-A1306 VanDerWaalsContact C-N 3.3Å; E1304-A1306 PolarHBondContact O-N 3.35Å; E1304-N1307 PolarHBondContact O-N 2.94Å; E1304-M1308 HydrophobicContact CB-CE 4.11Å; E1304-M1308 WeakPolarHBondContact O-CG 3.38Å; E1304-M1308 PolarHBondContact O-N 2.86Å; E1304-M1308 VanDerWaalsContact O-N 3.1Å
1305	F	90	Very high	86.9	Confident	20 Å²	20	61.9 Å²	61.9	9%	0.088	32%	0.322	C	S	.	.	H	α-helix	trans	-58.6	-39.3	177.8	179.4	-90.3	0	0	0	112.3	F463 P464 M1301 L1302 N1307 M1308 K1313 M1317	F463-F1305 HydrophobicContact CB-CD2 4.18Å; F463-F1305 HydrophobicContact CB-CE2 3.8Å; F463-F1305 HydrophobicContact CB-CZ 4.03Å; F463-F1305 HydrophobicContact CD1-CB 3.64Å; F463-F1305 AromaticContact CD1-CD1 3.82Å; F463-F1305 HydrophobicContact CD1-CD1 3.82Å; F463-F1305 AromaticContact CD1-CD2 3.34Å; F463-F1305 HydrophobicContact CD1-CD2 3.34Å; F463-F1305 HydrophobicContact CD1-CE1 4.3Å; F463-F1305 AromaticContact CD1-CE2 3.86Å; F463-F1305 HydrophobicContact CD1-CE2 3.86Å; F463-F1305 AromaticContact CD1-CG 3.31Å; F463-F1305 HydrophobicContact CD1-CG 3.31Å; F463-F1305 HydrophobicContact CD1-CZ 4.31Å; F463-F1305 HydrophobicContact CE1-CB 3.34Å; F463-F1305 HydrophobicContact CE1-CD1 4.4Å; F463-F1305 AromaticContact CE1-CD2 3.8Å; F463-F1305 HydrophobicContact CE1-CD2 3.8Å; F463-F1305 AromaticContact CE1-CG 3.62Å; F463-F1305 HydrophobicContact CE1-CG 3.62Å; F463-F1305 AromaticContact CG-CD2 3.78Å; F463-F1305 HydrophobicContact CG-CD2 3.78Å; F463-F1305 AromaticContact CG-CE2 3.93Å; F463-F1305 HydrophobicContact CG-CE2 3.93Å; F463-F1305 HydrophobicContact CG-CG 4.21Å; F463-F1305 HydrophobicContact CG-CZ 4.49Å; F463-F1305 HydrophobicContact CZ-CB 4.29Å; P464-F1305 HydrophobicContact CB-CE1 4.15Å; P464-F1305 HydrophobicContact CB-CZ 4.12Å; M1301-F1305 VanDerWaalsContact O-CB 3.27Å; M1301-F1305 WeakPolarHBondContact O-CB 3.29Å; M1301-F1305 PolarHBondContact O-N 2.96Å; L1302-F1305 PolarHBondContact O-N 3.44Å; F1305-N1307 PolarHBondContact O-N 3.43Å; F1305-M1308 HydrophobicContact CD2-SD 4.44Å; F1305-M1308 PolarHBondContact O-N 2.93Å; F1305-K1313 HydrophobicContact CD1-CG 4.5Å; F1305-K1313 HydrophobicContact CD2-CB 4.41Å; F1305-K1313 HydrophobicContact CD2-CG 4.06Å; F1305-K1313 HydrophobicContact CE1-CD 4.49Å; F1305-K1313 HydrophobicContact CE1-CG 4.17Å; F1305-K1313 HydrophobicContact CE2-CB 3.67Å; F1305-K1313 HydrophobicContact CE2-CG 3.72Å; F1305-K1313 HydrophobicContact CG-CG 4.44Å; F1305-K1313 HydrophobicContact CZ-CB 3.81Å; F1305-K1313 HydrophobicContact CZ-CD 4.42Å; F1305-K1313 HydrophobicContact CZ-CG 3.77Å; F1305-K1313 WeakPolarHBondContact O-CE 3.19Å; F1305-M1317 HydrophobicContact CE2-CG 4.15Å; F1305-M1317 HydrophobicContact CZ-CG 4.22Å; F1305-M1317 HydrophobicContact CZ-SD 4.12Å
1306	A	84.7	Confident	87.2	Confident	29 Å²	29	61.6 Å²	61.6	24%	0.24	32%	0.322	C	S	.	.	H	α-helix	trans	-57.1	-39	175.7	0	0	0	0	0	112.2	L1302 E1303 E1304 K1313	L1302-A1306 PolarHBondContact O-N 3.44Å; E1303-A1306 PolarHBondContact O-N 3.13Å; E1304-A1306 VanDerWaalsContact C-N 3.3Å; E1304-A1306 PolarHBondContact O-N 3.35Å; A1306-K1313 PolarHBondContact O-NZ 3.11Å
1307	N	87.7	Confident	87.5	Confident	143 Å²	143	58.8 Å²	58.8	77%	0.765	31%	0.309	S	S	*	.	H	α-helix	trans	-83.7	-12	-178	-68.6	-63.6	0	0	0	114.9	E1303 E1304 F1305	E1303-N1307 PolarHBondContact O-N 3.26Å; E1303-N1307 PolarHBondContact O-ND2 3.47Å; E1304-N1307 PolarHBondContact O-N 2.94Å; F1305-N1307 PolarHBondContact O-N 3.43Å
1308	M	87.8	Confident	87.6	Confident	46 Å²	46	57.1 Å²	57.1	23%	0.227	29%	0.294	C	S	.	.	S	Bend	trans	-67.1	154.7	178.4	-76.2	177.4	-160.7	0	0	113.4	E1304 F1305 Q1312 K1313 V1316	E1304-M1308 HydrophobicContact CB-CE 4.11Å; E1304-M1308 WeakPolarHBondContact O-CG 3.38Å; E1304-M1308 PolarHBondContact O-N 2.86Å; E1304-M1308 VanDerWaalsContact O-N 3.1Å; F1305-M1308 HydrophobicContact CD2-SD 4.44Å; F1305-M1308 PolarHBondContact O-N 2.93Å; M1308-Q1312 HydrophobicContact CB-CB 3.91Å; M1308-Q1312 HydrophobicContact CG-CB 4.15Å; M1308-Q1312 HydrophobicContact SD-CB 4.2Å; M1308-K1313 HydrophobicContact CB-CG 3.82Å; M1308-K1313 WeakPolarHBondContact O-CE 3.41Å; M1308-K1313 PolarHBondContact O-NZ 3.24Å; M1308-V1316 HydrophobicContact CE-CG2 4.5Å; M1308-V1316 HydrophobicContact SD-CG2 4.04Å
1309	N	88.2	Confident	87.8	Confident	63 Å²	63	59.7 Å²	59.7	34%	0.337	30%	0.302	S	S	.	.			trans	-70	168.2	169.9	82.7	4.6	0	0	0	111.1	T1311 Q1312 K1313 E1397	N1309-T1311 PolarHBondContact O-N 3.42Å; N1309-T1311 PolarHBondContact OD1-N 3.1Å; N1309-Q1312 VanDerWaalsContact N-OE1 3.11Å; N1309-Q1312 PolarHBondContact O-N 3.35Å; N1309-Q1312 WeakPolarHBondContact OD1-CB 3.47Å; N1309-Q1312 WeakPolarHBondContact OD1-CG 3.32Å; N1309-Q1312 PolarHBondContact OD1-N 3.48Å; N1309-K1313 WeakPolarHBondContact O-CB 3.41Å; N1309-K1313 VanDerWaalsContact O-CG 3.31Å; N1309-K1313 WeakPolarHBondContact O-CG 3.36Å; N1309-K1313 PolarHBondContact O-N 3.14Å; N1309-E1397 PolarHBondContact ND2-OE2 3.01Å
1310	T	85.6	Confident	88.2	Confident	115 Å²	115	57.1 Å²	57.1	71%	0.706	29%	0.286	S	S	*	.	H	α-helix	trans	-59.4	-41.9	-177.1	43.7	0	0	0	0	113	R1314	T1310-R1314 PolarHBondContact O-N 3.3Å
1311	T	85.2	Confident	88.5	Confident	2 Å²	2	50.9 Å²	50.9	1%	0.012	26%	0.257	C	S	.	.	H	α-helix	trans	-69.1	-42.2	179.7	-47.6	0	0	0	0	112.5	N1309 R1314 I1315 E1397 I1410 L1423	N1309-T1311 PolarHBondContact O-N 3.42Å; N1309-T1311 PolarHBondContact OD1-N 3.1Å; T1311-R1314 CarbonylContact O-C 3.57Å; T1311-R1314 WeakPolarHBondContact O-CB 3.4Å; T1311-R1314 PolarHBondContact O-N 3.39Å; T1311-R1314 VanDerWaalsContact O-N 3.14Å; T1311-I1315 HydrophobicContact CG2-CD1 4.45Å; T1311-I1315 WeakPolarHBondContact O-CG1 3.44Å; T1311-I1315 PolarHBondContact O-N 3.29Å; T1311-E1397 WeakPolarHBondContact CB-OE1 3.23Å; T1311-E1397 HydrophobicContact CG2-CB 3.79Å; T1311-E1397 HydrophobicContact CG2-CG 3.72Å; T1311-E1397 PolarHBondContact OG1-OE1 3.48Å; T1311-I1410 HydrophobicContact CG2-CG1 4.21Å; T1311-L1423 HydrophobicContact CG2-CD2 3.95Å
1312	Q	87.8	Confident	88.6	Confident	85 Å²	85	49.2 Å²	49.2	40%	0.397	25%	0.249	S	C	.	.	H	α-helix	trans	-61.6	-46.6	175.1	-73.5	164	0.5	0	0	111.2	M1308 N1309 R1314 I1315 V1316	M1308-Q1312 HydrophobicContact CB-CB 3.91Å; M1308-Q1312 HydrophobicContact CG-CB 4.15Å; M1308-Q1312 HydrophobicContact SD-CB 4.2Å; N1309-Q1312 VanDerWaalsContact N-OE1 3.11Å; N1309-Q1312 PolarHBondContact O-N 3.35Å; N1309-Q1312 WeakPolarHBondContact OD1-CB 3.47Å; N1309-Q1312 WeakPolarHBondContact OD1-CG 3.32Å; N1309-Q1312 PolarHBondContact OD1-N 3.48Å; Q1312-R1314 PolarHBondContact O-N 2.77Å; Q1312-I1315 PolarHBondContact O-N 2.76Å; Q1312-I1315 VanDerWaalsContact O-N 3.15Å; Q1312-V1316 WeakPolarHBondContact O-CG2 3.44Å; Q1312-V1316 PolarHBondContact O-N 2.69Å
1313	K	90.4	Very high	88.8	Confident	52 Å²	52	48.3 Å²	48.3	23%	0.226	24%	0.244	C	C	.	.	H	α-helix	trans	-52.2	-45.7	171.7	-75.3	167.5	171.3	151.3	0	110.5	F1305 A1306 M1308 N1309 V1316 M1317	F1305-K1313 HydrophobicContact CD1-CG 4.5Å; F1305-K1313 HydrophobicContact CD2-CB 4.41Å; F1305-K1313 HydrophobicContact CD2-CG 4.06Å; F1305-K1313 HydrophobicContact CE1-CD 4.49Å; F1305-K1313 HydrophobicContact CE1-CG 4.17Å; F1305-K1313 HydrophobicContact CE2-CB 3.67Å; F1305-K1313 HydrophobicContact CE2-CG 3.72Å; F1305-K1313 HydrophobicContact CG-CG 4.44Å; F1305-K1313 HydrophobicContact CZ-CB 3.81Å; F1305-K1313 HydrophobicContact CZ-CD 4.42Å; F1305-K1313 HydrophobicContact CZ-CG 3.77Å; F1305-K1313 WeakPolarHBondContact O-CE 3.19Å; A1306-K1313 PolarHBondContact O-NZ 3.11Å; M1308-K1313 HydrophobicContact CB-CG 3.82Å; M1308-K1313 WeakPolarHBondContact O-CE 3.41Å; M1308-K1313 PolarHBondContact O-NZ 3.24Å; N1309-K1313 WeakPolarHBondContact O-CB 3.41Å; N1309-K1313 VanDerWaalsContact O-CG 3.31Å; N1309-K1313 WeakPolarHBondContact O-CG 3.36Å; N1309-K1313 PolarHBondContact O-N 3.14Å; K1313-V1316 PolarHBondContact O-N 3.18Å; K1313-M1317 VanDerWaalsContact O-CG 3.31Å; K1313-M1317 WeakPolarHBondContact O-CG 3.28Å; K1313-M1317 PolarHBondContact O-N 2.83Å
1314	R	89.7	Confident	89.3	Confident	64 Å²	64	44.1 Å²	44.1	24%	0.242	23%	0.225	C	C	.	.	H	α-helix	trans	-67.5	-39.2	178.9	-158.8	68	-175.3	-168.6	0.3	113.4	T1310 T1311 Q1312 V1316 M1317 L1318 L1423 S1424	T1310-R1314 PolarHBondContact O-N 3.3Å; T1311-R1314 CarbonylContact O-C 3.57Å; T1311-R1314 WeakPolarHBondContact O-CB 3.4Å; T1311-R1314 PolarHBondContact O-N 3.39Å; T1311-R1314 VanDerWaalsContact O-N 3.14Å; Q1312-R1314 PolarHBondContact O-N 2.77Å; R1314-V1316 VanDerWaalsContact C-N 3.33Å; R1314-V1316 PolarHBondContact O-N 3.33Å; R1314-M1317 PolarHBondContact O-N 2.77Å; R1314-L1318 HydrophobicContact CG-CD1 4.1Å; R1314-L1318 HydrophobicContact CG-CG 4.31Å; R1314-L1318 WeakPolarHBondContact O-CB 3.18Å; R1314-L1318 VanDerWaalsContact O-CG 3.22Å; R1314-L1318 WeakPolarHBondContact O-CG 3.16Å; R1314-L1318 PolarHBondContact O-N 3.26Å; R1314-L1423 HydrophobicContact CB-CD2 4.45Å; R1314-L1423 WeakPolarHBondContact CD-O 3.28Å; R1314-L1423 HydrophobicContact CG-CB 4.27Å; R1314-L1423 HydrophobicContact CG-CD2 4.46Å; R1314-L1423 WeakPolarHBondContact CG-O 3.08Å; R1314-L1423 PolarHBondContact NE-O 3.07Å; R1314-S1424 PolarHBondContact NH2-O 3.37Å
1315	I	89.2	Confident	89.5	Confident	22 Å²	22	38.4 Å²	38.4	11%	0.113	20%	0.198	C	C	.	.	H	α-helix	trans	-57.9	-45.6	173.9	-70.3	167.5	0	0	0	110.9	T1311 Q1312 K1319 I1410	T1311-I1315 HydrophobicContact CG2-CD1 4.45Å; T1311-I1315 WeakPolarHBondContact O-CG1 3.44Å; T1311-I1315 PolarHBondContact O-N 3.29Å; Q1312-I1315 PolarHBondContact O-N 2.76Å; Q1312-I1315 VanDerWaalsContact O-N 3.15Å; I1315-K1319 WeakPolarHBondContact O-CG 3.2Å; I1315-K1319 PolarHBondContact O-N 3.44Å; I1315-I1410 HydrophobicContact CD1-CG1 4.36Å; I1315-I1410 HydrophobicContact CD1-CG2 4.32Å; I1315-I1410 HydrophobicContact CG1-CD1 3.65Å; I1315-I1410 HydrophobicContact CG1-CG1 3.82Å; I1315-I1410 HydrophobicContact CG1-CG2 3.88Å
1316	V	89.5	Confident	89.6	Confident	35 Å²	35	38.2 Å²	38.2	21%	0.212	20%	0.197	C	C	.	.	H	α-helix	trans	-67.9	-44.2	179.3	-179.1	0	0	0	0	110.9	F463 M1308 Q1312 K1313 R1314 L1318 K1319 E1320	F463-V1316 HydrophobicContact CD2-CG1 3.32Å; F463-V1316 HydrophobicContact CE2-CG1 3.31Å; F463-V1316 HydrophobicContact CG-CG1 4.06Å; F463-V1316 HydrophobicContact CZ-CG1 4.06Å; M1308-V1316 HydrophobicContact CE-CG2 4.5Å; M1308-V1316 HydrophobicContact SD-CG2 4.04Å; Q1312-V1316 WeakPolarHBondContact O-CG2 3.44Å; Q1312-V1316 PolarHBondContact O-N 2.69Å; K1313-V1316 PolarHBondContact O-N 3.18Å; R1314-V1316 VanDerWaalsContact C-N 3.33Å; R1314-V1316 PolarHBondContact O-N 3.33Å; V1316-L1318 PolarHBondContact O-N 3.23Å; V1316-K1319 PolarHBondContact O-N 2.9Å; V1316-E1320 PolarHBondContact O-N 3.35Å
1317	M	91.5	Very high	90.1	Very high	29 Å²	29	37.2 Å²	37.2	14%	0.143	19%	0.189	C	C	.	.	H	α-helix	trans	-57.9	-48.2	175.7	-74.5	170.8	58.7	0	0	112.4	R461 F463 P464 F1305 K1313 R1314 K1319 E1320 D1321	R461-M1317 PolarHBondContact NH2-O 2.99Å; F463-M1317 HydrophobicContact CB-CG 4.05Å; P464-M1317 HydrophobicContact CB-SD 4.27Å; P464-M1317 HydrophobicContact CG-CE 4.34Å; F1305-M1317 HydrophobicContact CE2-CG 4.15Å; F1305-M1317 HydrophobicContact CZ-CG 4.22Å; F1305-M1317 HydrophobicContact CZ-SD 4.12Å; K1313-M1317 VanDerWaalsContact O-CG 3.31Å; K1313-M1317 WeakPolarHBondContact O-CG 3.28Å; K1313-M1317 PolarHBondContact O-N 2.83Å; R1314-M1317 PolarHBondContact O-N 2.77Å; M1317-K1319 PolarHBondContact O-N 3.36Å; M1317-E1320 PolarHBondContact O-N 3.46Å; M1317-E1320 VanDerWaalsContact O-N 3.07Å; M1317-D1321 PolarHBondContact O-N 2.97Å
1318	L	88.9	Confident	90.5	Very high	7 Å²	7	30.4 Å²	30.4	4%	0.037	15%	0.152	C	C	.	.	H	α-helix	trans	-62.9	-27.2	-178.7	-71.2	169.7	0	0	0	113.1	R1314 V1316 R1322 F1362 I1410	R1314-L1318 HydrophobicContact CG-CD1 4.1Å; R1314-L1318 HydrophobicContact CG-CG 4.31Å; R1314-L1318 WeakPolarHBondContact O-CB 3.18Å; R1314-L1318 VanDerWaalsContact O-CG 3.22Å; R1314-L1318 WeakPolarHBondContact O-CG 3.16Å; R1314-L1318 PolarHBondContact O-N 3.26Å; V1316-L1318 PolarHBondContact O-N 3.23Å; L1318-R1322 WeakPolarHBondContact O-CB 3.44Å; L1318-R1322 PolarHBondContact O-N 2.81Å; L1318-F1362 HydrophobicContact CB-CE2 4.45Å; L1318-F1362 HydrophobicContact CD2-CD2 4.26Å; L1318-F1362 HydrophobicContact CD2-CE2 3.77Å; L1318-I1410 HydrophobicContact CD1-CD1 3.57Å
1319	K	88.9	Confident	90.8	Very high	85 Å²	85	30.1 Å²	30.1	37%	0.37	15%	0.149	S	C	.	.	H	α-helix	trans	-67.4	-47.7	171.6	-73	177.6	177.3	-176.4	0	111.1	I1315 V1316 M1317 R1322 L1323 M1387	I1315-K1319 WeakPolarHBondContact O-CG 3.2Å; I1315-K1319 PolarHBondContact O-N 3.44Å; V1316-K1319 PolarHBondContact O-N 2.9Å; M1317-K1319 PolarHBondContact O-N 3.36Å; K1319-R1322 PolarHBondContact O-N 2.86Å; K1319-L1323 PolarHBondContact O-N 2.65Å; K1319-L1323 VanDerWaalsContact O-N 3.11Å; K1319-M1387 WeakPolarHBondContact O-CE 3.22Å
1320	E	91.9	Very high	91.2	Very high	2 Å²	2	27.4 Å²	27.4	1%	0.009	14%	0.135	C	C	.	.	H	α-helix	trans	-64.5	-42	175.2	-68.4	-166.3	125.5	0	0	112.3	R461 L462 F463 R1289 V1316 M1317 R1322 L1323 L1324	R461-E1320 HydrophobicContact CG-CB 4.19Å; R461-E1320 VanDerWaalsContact CG-CD 3.49Å; R461-E1320 HydrophobicContact CG-CG 4.48Å; R461-E1320 WeakPolarHBondContact CG-OE2 3.16Å; R461-E1320 IonicContact NE-OE2 2.63Å; R461-E1320 PolarHBondContact NE-OE2 3.16Å; L462-E1320 PolarHBondContact N-OE1 2.95Å; L462-E1320 PolarHBondContact N-OE2 3.49Å; F463-E1320 WeakPolarHBondContact CB-OE2 3.2Å; F463-E1320 HydrophobicContact CD2-CG 4.4Å; F463-E1320 WeakPolarHBondContact CD2-OE2 3.39Å; F463-E1320 PolarHBondContact N-OE2 3.25Å; R1289-E1320 IonicContact CZ-OE1 3.25Å; R1289-E1320 IonicContact NH1-OE1 3.53Å; R1289-E1320 PolarHBondContact NH1-OE1 2.77Å; R1289-E1320 IonicContact NH2-OE1 3.9Å; V1316-E1320 PolarHBondContact O-N 3.35Å; M1317-E1320 PolarHBondContact O-N 3.46Å; M1317-E1320 VanDerWaalsContact O-N 3.07Å; E1320-R1322 VanDerWaalsContact C-N 3.33Å; E1320-R1322 PolarHBondContact O-N 2.61Å; E1320-L1323 PolarHBondContact O-N 3.42Å; E1320-L1324 WeakPolarHBondContact O-CG 3.34Å; E1320-L1324 PolarHBondContact O-N 3.48Å
1321	D	92.4	Very high	91.7	Very high	1 Å²	1	22 Å²	22	1%	0.005	10%	0.101	C	C	.	.	H	α-helix	trans	-58.1	-44.6	177.1	-72.5	-52.2	0	0	0	111.6	R461 M1317 A1325 I1358 G1359 F1362	R461-D1321 IonicContact CZ-OD1 2.72Å; R461-D1321 IonicContact CZ-OD2 2.88Å; R461-D1321 IonicContact NH1-OD1 2.7Å; R461-D1321 PolarHBondContact NH1-OD1 3.49Å; R461-D1321 IonicContact NH1-OD2 2.65Å; R461-D1321 IonicContact NH2-OD1 2.69Å; R461-D1321 PolarHBondContact NH2-OD1 2.92Å; R461-D1321 VanDerWaalsContact NH2-OD1 3.09Å; R461-D1321 IonicContact NH2-OD2 3.6Å; R461-D1321 PolarHBondContact NH2-OD2 2.98Å; M1317-D1321 PolarHBondContact O-N 2.97Å; D1321-A1325 WeakPolarHBondContact O-CB 3.17Å; D1321-A1325 PolarHBondContact O-N 3.4Å; D1321-I1358 HydrophobicContact CB-CG2 4.19Å; D1321-I1358 VanDerWaalsContact OD1-CA 3.28Å; D1321-I1358 WeakPolarHBondContact OD1-CA 3.36Å; D1321-G1359 PolarHBondContact OD1-N 2.88Å; D1321-F1362 HydrophobicContact CB-CB 4.28Å; D1321-F1362 HydrophobicContact CB-CD2 3.46Å; D1321-F1362 VanDerWaalsContact CB-CD2 3.46Å; D1321-F1362 HydrophobicContact CB-CE2 4.04Å; D1321-F1362 HydrophobicContact CB-CG 4.1Å
1322	R	89.7	Confident	92.2	Very high	2 Å²	2	21.9 Å²	21.9	1%	0.008	10%	0.1	C	C	.	.	H	α-helix	trans	-62.3	-46.8	176.8	-177	-179.2	-60.8	154.1	3	111.8	L1318 K1319 E1320 F1326 F1362 M1387 E1412 Y1414	L1318-R1322 WeakPolarHBondContact O-CB 3.44Å; L1318-R1322 PolarHBondContact O-N 2.81Å; K1319-R1322 PolarHBondContact O-N 2.86Å; E1320-R1322 VanDerWaalsContact C-N 3.33Å; E1320-R1322 PolarHBondContact O-N 2.61Å; R1322-F1326 HydrophobicContact CG-CD1 4.05Å; R1322-F1326 HydrophobicContact CG-CD2 4.21Å; R1322-F1326 HydrophobicContact CG-CE1 3.83Å; R1322-F1326 HydrophobicContact CG-CE2 4.01Å; R1322-F1326 HydrophobicContact CG-CG 4.26Å; R1322-F1326 HydrophobicContact CG-CZ 3.83Å; R1322-F1326 VanDerWaalsContact O-CB 3.3Å; R1322-F1326 WeakPolarHBondContact O-CB 3.41Å; R1322-F1326 WeakPolarHBondContact O-CD1 3.22Å; R1322-F1326 WeakPolarHBondContact O-CG 3.4Å; R1322-F1326 PolarHBondContact O-N 3.02Å; R1322-F1362 HydrophobicContact CB-CD1 4.49Å; R1322-F1362 HydrophobicContact CB-CE1 3.83Å; R1322-F1362 HydrophobicContact CB-CE2 4.35Å; R1322-F1362 HydrophobicContact CB-CZ 3.75Å; R1322-F1362 HydrophobicContact CG-CE1 4.04Å; R1322-F1362 HydrophobicContact CG-CZ 4.28Å; R1322-M1387 HydrophobicContact CB-CE 3.76Å; R1322-M1387 HydrophobicContact CG-CE 3.83Å; R1322-E1412 IonicContact CZ-OE1 2.75Å; R1322-E1412 VanDerWaalsContact CZ-OE1 3.27Å; R1322-E1412 IonicContact CZ-OE2 3.23Å; R1322-E1412 IonicContact NH1-OE1 3.4Å; R1322-E1412 PolarHBondContact NH1-OE1 2.82Å; R1322-E1412 IonicContact NH1-OE2 2.75Å; R1322-E1412 IonicContact NH2-OE1 3.78Å; R1322-E1412 PolarHBondContact NH2-OE1 3.24Å; R1322-E1412 IonicContact NH2-OE2 3.38Å; R1322-E1412 PolarHBondContact NH2-OE2 2.88Å; R1322-Y1414 PolarHBondContact NH1-OH 2.78Å
1323	L	92.9	Very high	92.6	Very high	1 Å²	1	17.8 Å²	17.8	1%	0.005	8%	0.082	C	C	.	.	H	α-helix	trans	-56.1	-53.1	178.6	173.1	61.8	0	0	0	110.9	E1288 R1289 L1292 L1294 K1319 E1320 F1326 C1327 M1387	E1288-L1323 HydrophobicContact CB-CD1 3.59Å; E1288-L1323 HydrophobicContact CB-CD2 4.49Å; E1288-L1323 HydrophobicContact CG-CD1 4.03Å; R1289-L1323 HydrophobicContact CG-CD2 3.69Å; L1292-L1323 HydrophobicContact CD1-CD1 4.44Å; L1292-L1323 HydrophobicContact CD1-CD2 4.29Å; L1294-L1323 HydrophobicContact CD1-CD2 4.2Å; K1319-L1323 PolarHBondContact O-N 2.65Å; K1319-L1323 VanDerWaalsContact O-N 3.11Å; E1320-L1323 PolarHBondContact O-N 3.42Å; L1323-F1326 PolarHBondContact O-N 3.44Å; L1323-C1327 WeakPolarHBondContact O-CB 3.31Å; L1323-C1327 PolarHBondContact O-N 3.37Å; L1323-C1327 PolarHBondContact O-SG 3.23Å; L1323-C1327 VanDerWaalsContact O-SG 3.4Å; L1323-M1387 HydrophobicContact CB-CE 4.34Å; L1323-M1387 HydrophobicContact CB-SD 4Å; L1323-M1387 HydrophobicContact CD1-CB 3.88Å
1324	L	94.7	Very high	92.9	Very high	1 Å²	1	15.5 Å²	15.5	1%	0.005	7%	0.072	C	C	.	.	H	α-helix	trans	-66.1	-42.7	-176.5	-64.8	170.1	0	0	0	111.9	I460 R461 F1281 V1285 E1320 C1327 L1328 C1356 I1358	I460-L1324 HydrophobicContact CG2-CD1 4.16Å; I460-L1324 HydrophobicContact CG2-CD2 3.52Å; R461-L1324 HydrophobicContact CB-CD1 4.21Å; R461-L1324 HydrophobicContact CG-CD1 4.19Å; F1281-L1324 HydrophobicContact CZ-CD2 4.25Å; V1285-L1324 HydrophobicContact CB-CD2 4.46Å; V1285-L1324 HydrophobicContact CG1-CD2 3.66Å; V1285-L1324 HydrophobicContact CG2-CD2 3.87Å; E1320-L1324 WeakPolarHBondContact O-CG 3.34Å; E1320-L1324 PolarHBondContact O-N 3.48Å; L1324-C1327 PolarHBondContact O-N 3.38Å; L1324-L1328 WeakPolarHBondContact O-CB 3.36Å; L1324-L1328 WeakPolarHBondContact O-CG 3.4Å; L1324-L1328 PolarHBondContact O-N 2.66Å; L1324-C1356 HydrophobicContact CD1-CB 4.24Å; L1324-I1358 HydrophobicContact CB-CD1 3.7Å; L1324-I1358 HydrophobicContact CB-CG1 3.91Å; L1324-I1358 HydrophobicContact CD1-CG1 4.37Å
1325	A	92.8	Very high	93.2	Very high	2 Å²	2	12.5 Å²	12.5	2%	0.017	6%	0.06	C	C	.	.	H	α-helix	trans	-65.5	-40.8	177.6	0	0	0	0	0	112.6	D1321 L1328 Y1329 I1358 F1362	D1321-A1325 WeakPolarHBondContact O-CB 3.17Å; D1321-A1325 PolarHBondContact O-N 3.4Å; A1325-L1328 PolarHBondContact O-N 3.01Å; A1325-Y1329 WeakPolarHBondContact O-CB 3.29Å; A1325-Y1329 PolarHBondContact O-N 3Å; A1325-I1358 HydrophobicContact CB-CG2 4.42Å; A1325-F1362 HydrophobicContact CB-CB 3.86Å; A1325-F1362 HydrophobicContact CB-CD1 4.25Å; A1325-F1362 HydrophobicContact CB-CG 4.42Å
1326	F	92.7	Very high	93.5	Very high	16 Å²	16	11.8 Å²	11.8	7%	0.07	6%	0.057	C	C	.	.	H	α-helix	trans	-68.2	-41.1	178.8	-77.4	21.2	0	0	0	111.2	R1322 L1323 Y1329 N1330 L1384 P1385	R1322-F1326 HydrophobicContact CG-CD1 4.05Å; R1322-F1326 HydrophobicContact CG-CD2 4.21Å; R1322-F1326 HydrophobicContact CG-CE1 3.83Å; R1322-F1326 HydrophobicContact CG-CE2 4.01Å; R1322-F1326 HydrophobicContact CG-CG 4.26Å; R1322-F1326 HydrophobicContact CG-CZ 3.83Å; R1322-F1326 VanDerWaalsContact O-CB 3.3Å; R1322-F1326 WeakPolarHBondContact O-CB 3.41Å; R1322-F1326 WeakPolarHBondContact O-CD1 3.22Å; R1322-F1326 WeakPolarHBondContact O-CG 3.4Å; R1322-F1326 PolarHBondContact O-N 3.02Å; L1323-F1326 PolarHBondContact O-N 3.44Å; F1326-Y1329 PolarHBondContact O-N 3.11Å; F1326-N1330 WeakPolarHBondContact O-CB 3.14Å; F1326-N1330 PolarHBondContact O-N 3Å; F1326-L1384 HydrophobicContact CD1-CD1 3.73Å; F1326-L1384 HydrophobicContact CD2-CB 4.19Å; F1326-L1384 HydrophobicContact CE1-CD1 3.86Å; F1326-L1384 HydrophobicContact CE2-CB 4.47Å; F1326-L1384 HydrophobicContact CG-CB 4.34Å; F1326-L1384 HydrophobicContact CG-CD1 4.08Å; F1326-L1384 HydrophobicContact CZ-CD1 4.31Å; F1326-P1385 WeakPolarHBondContact CD2-O 3.09Å
1327	C	94.9	Very high	93.7	Very high	9 Å²	9	10.1 Å²	10.1	6%	0.061	5%	0.046	C	C	.	.	H	α-helix	trans	-60.6	-46.2	172.4	-72.8	0	0	0	0	112.1	F1281 V1285 L1323 L1324 L1331	F1281-C1327 HydrophobicContact CD2-CB 4.15Å; F1281-C1327 HydrophobicContact CE2-CB 3.72Å; V1285-C1327 HydrophobicContact CG2-CB 4.14Å; L1323-C1327 WeakPolarHBondContact O-CB 3.31Å; L1323-C1327 PolarHBondContact O-N 3.37Å; L1323-C1327 PolarHBondContact O-SG 3.23Å; L1323-C1327 VanDerWaalsContact O-SG 3.4Å; L1324-C1327 PolarHBondContact O-N 3.38Å; C1327-L1331 VanDerWaalsContact O-CB 3.27Å; C1327-L1331 WeakPolarHBondContact O-CB 3.33Å; C1327-L1331 PolarHBondContact O-N 2.88Å
1328	L	95.4	Very high	93.8	Very high	0 Å²	0	8.8 Å²	8.8	0%	0	4%	0.04	C	C	.	.	H	α-helix	trans	-66.8	-38.1	177.2	-75.2	174.3	0	0	0	113.3	F1281 L1324 A1325 L1331 T1332 V1349 L1352 L1353 I1358 T1366	F1281-L1328 HydrophobicContact CD1-CD2 4.4Å; F1281-L1328 HydrophobicContact CD2-CD2 3.82Å; F1281-L1328 HydrophobicContact CD2-CG 4.25Å; F1281-L1328 HydrophobicContact CE1-CD2 4.15Å; F1281-L1328 HydrophobicContact CE2-CB 4.48Å; F1281-L1328 HydrophobicContact CE2-CD2 3.53Å; F1281-L1328 HydrophobicContact CE2-CG 3.51Å; F1281-L1328 HydrophobicContact CG-CD2 4.26Å; F1281-L1328 HydrophobicContact CZ-CD1 4.3Å; F1281-L1328 HydrophobicContact CZ-CD2 3.71Å; F1281-L1328 HydrophobicContact CZ-CG 3.71Å; L1324-L1328 WeakPolarHBondContact O-CB 3.36Å; L1324-L1328 WeakPolarHBondContact O-CG 3.4Å; L1324-L1328 PolarHBondContact O-N 2.66Å; A1325-L1328 PolarHBondContact O-N 3.01Å; L1328-L1331 HydrophobicContact CD2-CD2 4.42Å; L1328-L1331 PolarHBondContact O-N 2.78Å; L1328-T1332 WeakPolarHBondContact O-CB 3.28Å; L1328-T1332 PolarHBondContact O-N 3.27Å; L1328-T1332 PolarHBondContact O-OG1 3.02Å; L1328-V1349 HydrophobicContact CD2-CG1 4.5Å; L1328-L1352 HydrophobicContact CD2-CB 3.81Å; L1328-L1352 HydrophobicContact CD2-CD1 4.18Å; L1328-L1353 HydrophobicContact CD1-CB 4.33Å; L1328-L1353 HydrophobicContact CD1-CD1 3.76Å; L1328-I1358 HydrophobicContact CD1-CD1 3.74Å; L1328-T1366 HydrophobicContact CB-CG2 4.27Å
1329	Y	95.3	Very high	94	Very high	39 Å²	39	13.1 Å²	13.1	15%	0.153	6%	0.063	C	C	.	.	H	α-helix	trans	-61.7	-50.7	176.6	-178.6	-80.6	0	0	0	110.8	A1325 F1326 L1331 T1332 A1333 I1365 L1369 I1381 D1382 L1384	A1325-Y1329 WeakPolarHBondContact O-CB 3.29Å; A1325-Y1329 PolarHBondContact O-N 3Å; F1326-Y1329 PolarHBondContact O-N 3.11Å; Y1329-L1331 PolarHBondContact O-N 2.82Å; Y1329-T1332 WeakPolarHBondContact O-CB 3.49Å; Y1329-T1332 PolarHBondContact O-N 3.21Å; Y1329-A1333 PolarHBondContact O-N 2.99Å; Y1329-I1365 HydrophobicContact CD2-CG2 4.04Å; Y1329-I1365 HydrophobicContact CE2-CG2 4.28Å; Y1329-L1369 HydrophobicContact CD2-CD2 3.76Å; Y1329-L1369 HydrophobicContact CE2-CB 4.45Å; Y1329-L1369 HydrophobicContact CE2-CD2 3.83Å; Y1329-L1369 HydrophobicContact CE2-CG 4.5Å; Y1329-L1369 HydrophobicContact CG-CD2 4.24Å; Y1329-I1381 HydrophobicContact CE1-CG2 3.67Å; Y1329-I1381 WeakPolarHBondContact OH-CG2 3.46Å; Y1329-D1382 WeakPolarHBondContact CE1-O 3.49Å; Y1329-L1384 HydrophobicContact CD1-CB 4.47Å; Y1329-L1384 HydrophobicContact CD1-CD1 3.64Å; Y1329-L1384 HydrophobicContact CD1-CG 3.72Å; Y1329-L1384 HydrophobicContact CD2-CD1 4.22Å; Y1329-L1384 HydrophobicContact CE1-CD1 4.05Å; Y1329-L1384 HydrophobicContact CE1-CG 3.8Å; Y1329-L1384 HydrophobicContact CG-CD1 3.75Å; Y1329-L1384 HydrophobicContact CG-CG 4.34Å
1330	N	95.4	Very high	94.2	Very high	7 Å²	7	9.3 Å²	9.3	4%	0.037	5%	0.047	C	C	.	.	H	α-helix	trans	-65.1	-40.2	177.8	-72.7	-15.7	0	0	0	112	M1061 F1326 T1332 A1333 Y1334 L1384	M1061-N1330 HydrophobicContact CE-CB 4.13Å; F1326-N1330 WeakPolarHBondContact O-CB 3.14Å; F1326-N1330 PolarHBondContact O-N 3Å; N1330-T1332 VanDerWaalsContact C-N 3.3Å; N1330-T1332 PolarHBondContact O-N 3.49Å; N1330-A1333 WeakPolarHBondContact O-CB 3.31Å; N1330-A1333 PolarHBondContact O-N 2.94Å; N1330-Y1334 HydrophobicContact CB-CE2 4.15Å; N1330-Y1334 WeakPolarHBondContact O-CD2 3.25Å; N1330-Y1334 PolarHBondContact O-N 2.83Å; N1330-L1384 PolarHBondContact ND2-O 3.28Å; N1330-L1384 PolarHBondContact OD1-N 2.81Å
1331	L	96.6	Very high	94.3	Very high	0 Å²	0	13.9 Å²	13.9	0%	0	7%	0.071	C	C	.	.	H	α-helix	trans	-56.9	-44.9	173	-168.6	81.8	0	0	0	111	M1061 W1277 T1280 F1281 C1327 L1328 Y1329 A1333 Y1334 M1335 L1352	M1061-L1331 HydrophobicContact CE-CB 4.49Å; M1061-L1331 HydrophobicContact SD-CD1 4.02Å; W1277-L1331 HydrophobicContact CE3-CD1 3.84Å; W1277-L1331 HydrophobicContact CE3-CG 4.33Å; W1277-L1331 HydrophobicContact CZ3-CD1 4.47Å; T1280-L1331 HydrophobicContact CG2-CD1 4.47Å; F1281-L1331 HydrophobicContact CB-CD1 4.42Å; F1281-L1331 HydrophobicContact CB-CD2 3.93Å; F1281-L1331 HydrophobicContact CD2-CD2 4.37Å; F1281-L1331 HydrophobicContact CG-CD2 4.35Å; C1327-L1331 VanDerWaalsContact O-CB 3.27Å; C1327-L1331 WeakPolarHBondContact O-CB 3.33Å; C1327-L1331 PolarHBondContact O-N 2.88Å; L1328-L1331 HydrophobicContact CD2-CD2 4.42Å; L1328-L1331 PolarHBondContact O-N 2.78Å; Y1329-L1331 PolarHBondContact O-N 2.82Å; L1331-A1333 PolarHBondContact O-N 3.14Å; L1331-Y1334 PolarHBondContact O-N 2.96Å; L1331-M1335 HydrophobicContact CD2-SD 4.48Å; L1331-M1335 HydrophobicContact CG-SD 4.35Å; L1331-M1335 VanDerWaalsContact O-CG 3.29Å; L1331-M1335 WeakPolarHBondContact O-CG 3.41Å; L1331-M1335 PolarHBondContact O-N 2.97Å; L1331-L1352 HydrophobicContact CD2-CD1 4.2Å
1332	T	96.6	Very high	94.4	Very high	0 Å²	0	16.7 Å²	16.7	0%	0	8%	0.083	C	C	.	.	H	α-helix	trans	-61.4	-44.1	177.5	-56.5	0	0	0	0	111.5	L1328 Y1329 N1330 Y1334 M1335 I1336 L1345 V1349 L1369 L1370	L1328-T1332 WeakPolarHBondContact O-CB 3.28Å; L1328-T1332 PolarHBondContact O-N 3.27Å; L1328-T1332 PolarHBondContact O-OG1 3.02Å; Y1329-T1332 WeakPolarHBondContact O-CB 3.49Å; Y1329-T1332 PolarHBondContact O-N 3.21Å; N1330-T1332 VanDerWaalsContact C-N 3.3Å; N1330-T1332 PolarHBondContact O-N 3.49Å; T1332-Y1334 VanDerWaalsContact C-N 3.35Å; T1332-Y1334 PolarHBondContact O-N 2.92Å; T1332-M1335 PolarHBondContact O-N 3.42Å; T1332-I1336 HydrophobicContact CG2-CD1 4.21Å; T1332-I1336 WeakPolarHBondContact O-CG1 3.47Å; T1332-I1336 PolarHBondContact O-N 2.83Å; T1332-I1336 VanDerWaalsContact O-N 3.15Å; T1332-L1345 HydrophobicContact CG2-CD2 4.2Å; T1332-V1349 WeakPolarHBondContact OG1-CG1 3.39Å; T1332-L1369 HydrophobicContact CG2-CD2 3.61Å; T1332-L1369 HydrophobicContact CG2-CG 4.12Å; T1332-L1370 HydrophobicContact CG2-CD2 3.77Å
1333	A	95.7	Very high	94.5	Very high	0 Å²	0	18.5 Å²	18.5	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-58.7	-45.1	174.1	0	0	0	0	0	111.7	Y1329 N1330 L1331 I1336 L1337 I1381 L1383	Y1329-A1333 PolarHBondContact O-N 2.99Å; N1330-A1333 WeakPolarHBondContact O-CB 3.31Å; N1330-A1333 PolarHBondContact O-N 2.94Å; L1331-A1333 PolarHBondContact O-N 3.14Å; A1333-I1336 PolarHBondContact O-N 3.01Å; A1333-L1337 WeakPolarHBondContact O-CB 3.44Å; A1333-L1337 PolarHBondContact O-N 2.99Å; A1333-I1381 HydrophobicContact CB-CB 3.93Å; A1333-I1381 HydrophobicContact CB-CD1 4.23Å; A1333-I1381 HydrophobicContact CB-CG2 3.78Å; A1333-L1383 HydrophobicContact CB-CD2 3.76Å
1334	Y	96.8	Very high	94.6	Very high	4 Å²	4	22.6 Å²	22.6	2%	0.016	12%	0.124	C	C	.	.	H	α-helix	trans	-68.7	-34	178.3	-58.4	-36.7	0	0	0	114.2	M1061 L1064 E1065 H1068 N1330 L1331 T1332 I1336 L1337 M1338 L1383	M1061-Y1334 HydrophobicContact CB-CE2 4.47Å; M1061-Y1334 HydrophobicContact CE-CD2 3.99Å; M1061-Y1334 HydrophobicContact CE-CE2 3.66Å; M1061-Y1334 HydrophobicContact SD-CD2 3.58Å; M1061-Y1334 VanDerWaalsContact SD-CD2 3.58Å; M1061-Y1334 HydrophobicContact SD-CE2 3.59Å; M1061-Y1334 VanDerWaalsContact SD-CE2 3.59Å; L1064-Y1334 VanDerWaalsContact C-CE1 3.5Å; L1064-Y1334 HydrophobicContact CB-CD1 3.6Å; L1064-Y1334 HydrophobicContact CB-CD2 3.71Å; L1064-Y1334 HydrophobicContact CB-CE1 3.84Å; L1064-Y1334 HydrophobicContact CB-CE2 3.96Å; L1064-Y1334 HydrophobicContact CB-CG 3.53Å; L1064-Y1334 HydrophobicContact CD1-CD2 4.01Å; L1064-Y1334 HydrophobicContact CD1-CG 4.09Å; L1064-Y1334 HydrophobicContact CG-CD2 4.47Å; L1064-Y1334 HydrophobicContact CG-CG 4.28Å; E1065-Y1334 WeakPolarHBondContact CA-OH 3.25Å; E1065-Y1334 WeakPolarHBondContact CB-OH 3.35Å; E1065-Y1334 PolarHBondContact N-OH 3.24Å; H1068-Y1334 HydrophobicContact CB-CE1 4.26Å; N1330-Y1334 HydrophobicContact CB-CE2 4.15Å; N1330-Y1334 WeakPolarHBondContact O-CD2 3.25Å; N1330-Y1334 PolarHBondContact O-N 2.83Å; L1331-Y1334 PolarHBondContact O-N 2.96Å; T1332-Y1334 VanDerWaalsContact C-N 3.35Å; T1332-Y1334 PolarHBondContact O-N 2.92Å; Y1334-I1336 VanDerWaalsContact C-N 3.3Å; Y1334-I1336 PolarHBondContact O-N 3.21Å; Y1334-L1337 HydrophobicContact CD1-CD2 4.35Å; Y1334-L1337 WeakPolarHBondContact O-CB 3.48Å; Y1334-L1337 PolarHBondContact O-N 3.24Å; Y1334-M1338 WeakPolarHBondContact O-CG 3.47Å; Y1334-M1338 PolarHBondContact O-N 3.28Å; Y1334-L1383 HydrophobicContact CD1-CD2 4.14Å; Y1334-L1383 HydrophobicContact CE1-CD1 3.72Å; Y1334-L1383 HydrophobicContact CE1-CD2 3.5Å; Y1334-L1383 HydrophobicContact CE1-CG 4.26Å
1335	M	96.2	Very high	94.6	Very high	0 Å²	0	22.5 Å²	22.5	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-65.4	-35.9	174	-69.6	175.1	81.8	0	0	111.5	M1274 W1277 L1331 T1332 N1339 V1340 L1345 V1349	M1274-M1335 HydrophobicContact CE-CE 3.92Å; M1274-M1335 HydrophobicContact SD-CE 3.56Å; M1274-M1335 VanDerWaalsContact SD-CE 3.56Å; W1277-M1335 HydrophobicContact CB-CE 4.42Å; W1277-M1335 HydrophobicContact CB-SD 4.47Å; W1277-M1335 HydrophobicContact CD2-CE 4.42Å; W1277-M1335 HydrophobicContact CD2-CG 3.55Å; W1277-M1335 HydrophobicContact CD2-SD 4.27Å; W1277-M1335 HydrophobicContact CE3-CG 3.47Å; W1277-M1335 VanDerWaalsContact CE3-CG 3.47Å; W1277-M1335 HydrophobicContact CE3-SD 4.39Å; W1277-M1335 HydrophobicContact CG-CE 4.1Å; W1277-M1335 HydrophobicContact CG-CG 4.18Å; W1277-M1335 HydrophobicContact CG-SD 4.33Å; W1277-M1335 HydrophobicContact CH2-CB 4.49Å; W1277-M1335 HydrophobicContact CH2-CG 3.95Å; W1277-M1335 HydrophobicContact CZ2-CG 4.02Å; W1277-M1335 HydrophobicContact CZ3-CG 3.68Å; L1331-M1335 HydrophobicContact CD2-SD 4.48Å; L1331-M1335 HydrophobicContact CG-SD 4.35Å; L1331-M1335 VanDerWaalsContact O-CG 3.29Å; L1331-M1335 WeakPolarHBondContact O-CG 3.41Å; L1331-M1335 PolarHBondContact O-N 2.97Å; T1332-M1335 PolarHBondContact O-N 3.42Å; M1335-N1339 PolarHBondContact O-N 2.92Å; M1335-V1340 HydrophobicContact CB-CB 4.26Å; M1335-V1340 HydrophobicContact CB-CG2 4.13Å; M1335-V1340 HydrophobicContact CE-CG1 4.1Å; M1335-V1340 VanDerWaalsContact O-CB 3.3Å; M1335-V1340 WeakPolarHBondContact O-CB 3.24Å; M1335-V1340 VanDerWaalsContact O-CG2 3.3Å; M1335-V1340 WeakPolarHBondContact O-CG2 3.38Å; M1335-V1340 PolarHBondContact O-N 2.83Å; M1335-L1345 HydrophobicContact CB-CD1 3.48Å; M1335-L1345 VanDerWaalsContact CB-CD1 3.48Å; M1335-L1345 HydrophobicContact CB-CG 3.98Å; M1335-L1345 HydrophobicContact CE-CB 4.1Å; M1335-L1345 HydrophobicContact CE-CG 3.9Å; M1335-L1345 HydrophobicContact SD-CG 4.15Å; M1335-V1349 HydrophobicContact SD-CG2 3.9Å
1336	I	95	Very high	94.8	Very high	8 Å²	8	23.7 Å²	23.7	4%	0.041	13%	0.13	C	C	.	.	H	α-helix	trans	-71	-43.9	173.8	-68.1	163.4	0	0	0	110.6	T1332 A1333 Y1334 M1338 N1339 L1345 V1373 L1376 I1381	T1332-I1336 HydrophobicContact CG2-CD1 4.21Å; T1332-I1336 WeakPolarHBondContact O-CG1 3.47Å; T1332-I1336 PolarHBondContact O-N 2.83Å; T1332-I1336 VanDerWaalsContact O-N 3.15Å; A1333-I1336 PolarHBondContact O-N 3.01Å; Y1334-I1336 VanDerWaalsContact C-N 3.3Å; Y1334-I1336 PolarHBondContact O-N 3.21Å; I1336-M1338 VanDerWaalsContact C-N 3.3Å; I1336-M1338 PolarHBondContact O-N 3.11Å; I1336-N1339 PolarHBondContact O-N 3.39Å; I1336-L1345 HydrophobicContact CG1-CD1 3.74Å; I1336-V1373 HydrophobicContact CD1-CG1 4.08Å; I1336-V1373 HydrophobicContact CD1-CG2 3.99Å; I1336-V1373 HydrophobicContact CG1-CG1 4.32Å; I1336-L1376 HydrophobicContact CD1-CB 4.44Å; I1336-I1381 HydrophobicContact CB-CD1 4.41Å; I1336-I1381 HydrophobicContact CD1-CD1 3.43Å; I1336-I1381 VanDerWaalsContact CD1-CD1 3.43Å; I1336-I1381 HydrophobicContact CG1-CD1 4.49Å
1337	L	93.9	Very high	94.9	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-53.6	-44.5	175.1	-169.3	75.7	0	0	0	112.4	C1067 H1068 Y1258 A1333 Y1334 N1339 N1379	C1067-L1337 HydrophobicContact CB-CD2 4.21Å; H1068-L1337 HydrophobicContact CB-CD2 3.89Å; Y1258-L1337 HydrophobicContact CD1-CD1 3.36Å; Y1258-L1337 HydrophobicContact CD1-CG 4.18Å; Y1258-L1337 HydrophobicContact CD2-CD1 3.73Å; Y1258-L1337 HydrophobicContact CD2-CG 3.98Å; Y1258-L1337 HydrophobicContact CE1-CD1 3.71Å; Y1258-L1337 HydrophobicContact CE2-CD1 4.07Å; Y1258-L1337 HydrophobicContact CG-CD1 3.37Å; Y1258-L1337 HydrophobicContact CG-CD2 4.38Å; Y1258-L1337 HydrophobicContact CG-CG 3.71Å; A1333-L1337 WeakPolarHBondContact O-CB 3.44Å; A1333-L1337 PolarHBondContact O-N 2.99Å; Y1334-L1337 HydrophobicContact CD1-CD2 4.35Å; Y1334-L1337 WeakPolarHBondContact O-CB 3.48Å; Y1334-L1337 PolarHBondContact O-N 3.24Å; L1337-N1339 VanDerWaalsContact C-N 3.26Å; L1337-N1339 PolarHBondContact O-N 3.4Å; L1337-N1379 HydrophobicContact CD1-CB 3.7Å
1338	M	93.9	Very high	94.9	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	14%	0.142	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.9	11.6	-178.9	-59.1	-46.6	-63.6	0	0	114	L1064 L1261 I1262 R1267 W1271 W1277 Y1334 I1336 V1340	L1064-M1338 HydrophobicContact CD2-CG 3.65Å; L1064-M1338 HydrophobicContact CD2-SD 3.98Å; L1261-M1338 HydrophobicContact CB-CE 3.99Å; I1262-M1338 HydrophobicContact CG2-CE 4.03Å; I1262-M1338 HydrophobicContact CG2-SD 4.46Å; R1267-M1338 PolarHBondContact NE-O 3.11Å; R1267-M1338 PolarHBondContact NH2-O 3.09Å; R1267-M1338 VanDerWaalsContact NH2-O 3.1Å; W1271-M1338 HydrophobicContact CB-CB 4.36Å; W1271-M1338 HydrophobicContact CD2-CB 4.37Å; W1271-M1338 HydrophobicContact CD2-CE 4.2Å; W1271-M1338 HydrophobicContact CD2-CG 4.32Å; W1271-M1338 HydrophobicContact CG-CB 4.15Å; W1271-M1338 HydrophobicContact CG-CE 4.38Å; W1271-M1338 HydrophobicContact CZ2-CE 3.95Å; W1271-M1338 VanDerWaalsContact NE1-CE 3.33Å; W1277-M1338 HydrophobicContact CH2-CB 4.31Å; W1277-M1338 HydrophobicContact CH2-CG 4.18Å; W1277-M1338 HydrophobicContact CZ2-CB 4.28Å; Y1334-M1338 WeakPolarHBondContact O-CG 3.47Å; Y1334-M1338 PolarHBondContact O-N 3.28Å; I1336-M1338 VanDerWaalsContact C-N 3.3Å; I1336-M1338 PolarHBondContact O-N 3.11Å; M1338-V1340 PolarHBondContact O-N 3.01Å
1339	N	92.2	Very high	94.9	Very high	98 Å²	98	25.8 Å²	25.8	52%	0.524	14%	0.142	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.3	50.1	177.2	-166.5	12.9	0	0	0	112.6	R1267 M1335 I1336 L1337	R1267-N1339 PolarHBondContact NH2-O 3.37Å; R1267-N1339 VanDerWaalsContact NH2-O 3.09Å; M1335-N1339 PolarHBondContact O-N 2.92Å; I1336-N1339 PolarHBondContact O-N 3.39Å; L1337-N1339 VanDerWaalsContact C-N 3.26Å; L1337-N1339 PolarHBondContact O-N 3.4Å
1340	V	93.9	Very high	94.9	Very high	5 Å²	5	28.9 Å²	28.9	3%	0.03	15%	0.153	C	C	.	.			trans	-73.2	146.2	169.8	178.7	0	0	0	0	109.3	W1271 M1274 W1277 M1335 M1338 K1342 L1345	W1271-V1340 WeakPolarHBondContact O-CG2 3.49Å; M1274-V1340 HydrophobicContact CE-CG1 3.58Å; W1277-V1340 HydrophobicContact CZ2-CG2 3.74Å; M1335-V1340 HydrophobicContact CB-CB 4.26Å; M1335-V1340 HydrophobicContact CB-CG2 4.13Å; M1335-V1340 HydrophobicContact CE-CG1 4.1Å; M1335-V1340 VanDerWaalsContact O-CB 3.3Å; M1335-V1340 WeakPolarHBondContact O-CB 3.24Å; M1335-V1340 VanDerWaalsContact O-CG2 3.3Å; M1335-V1340 WeakPolarHBondContact O-CG2 3.38Å; M1335-V1340 PolarHBondContact O-N 2.83Å; M1338-V1340 PolarHBondContact O-N 3.01Å; V1340-K1342 PolarHBondContact O-N 3.1Å; V1340-K1342 VanDerWaalsContact O-N 3.08Å; V1340-L1345 HydrophobicContact CG1-CB 4.28Å
1341	N	93.8	Very high	94.8	Very high	98 Å²	98	36.3 Å²	36.3	52%	0.524	18%	0.18	S	C	.	.			trans	-56.2	117.8	177.5	-179.1	-71.2	0	0	0	111.2	G1343 I1344 L1345	N1341-G1343 VanDerWaalsContact C-N 3.26Å; N1341-G1343 PolarHBondContact O-N 3.45Å; N1341-G1343 VanDerWaalsContact O-N 3.16Å; N1341-G1343 PolarHBondContact OD1-N 3.08Å; N1341-I1344 HydrophobicContact CB-CB 4.3Å; N1341-I1344 HydrophobicContact CB-CD1 4.06Å; N1341-I1344 HydrophobicContact CB-CG1 4.17Å; N1341-I1344 PolarHBondContact O-N 3.41Å; N1341-I1344 VanDerWaalsContact O-N 3.14Å; N1341-I1344 PolarHBondContact OD1-N 2.86Å; N1341-L1345 WeakPolarHBondContact O-CB 3.49Å; N1341-L1345 PolarHBondContact O-N 3.37Å
1342	K	93.2	Very high	94.7	Very high	60 Å²	60	36.4 Å²	36.4	26%	0.261	18%	0.181	S	C	.	.	H	α-helix	trans	-55.7	-34.4	-173.7	-62.2	-173.4	-179.3	-160.9	0	113.8	V1340 V1346 V1373 L1376 D1377	V1340-K1342 PolarHBondContact O-N 3.1Å; V1340-K1342 VanDerWaalsContact O-N 3.08Å; K1342-V1346 WeakPolarHBondContact O-CG2 3.29Å; K1342-V1346 PolarHBondContact O-N 3.08Å; K1342-V1346 VanDerWaalsContact O-N 3.09Å; K1342-V1373 HydrophobicContact CB-CG1 3.94Å; K1342-V1373 HydrophobicContact CD-CG1 4Å; K1342-V1373 WeakPolarHBondContact CD-O 3.47Å; K1342-V1373 HydrophobicContact CG-CG1 3.89Å; K1342-V1373 PolarHBondContact NZ-O 3.22Å; K1342-V1373 VanDerWaalsContact NZ-O 3.12Å; K1342-L1376 PolarHBondContact NZ-O 2.87Å; K1342-D1377 WeakPolarHBondContact CE-OD1 3.5Å; K1342-D1377 IonicContact NZ-OD1 3.61Å; K1342-D1377 PolarHBondContact NZ-OD1 3.48Å; K1342-D1377 IonicContact NZ-OD2 3.03Å; K1342-D1377 PolarHBondContact NZ-OD2 3.43Å
1343	G	93.1	Very high	94.5	Very high	40 Å²	40	37.3 Å²	37.3	41%	0.412	19%	0.185	S	C	.	.	H	α-helix	trans	-72.7	-44.6	178.1	0	0	0	0	0	113	N1341 L1345 N1347	N1341-G1343 VanDerWaalsContact C-N 3.26Å; N1341-G1343 PolarHBondContact O-N 3.45Å; N1341-G1343 VanDerWaalsContact O-N 3.16Å; N1341-G1343 PolarHBondContact OD1-N 3.08Å; G1343-L1345 VanDerWaalsContact C-N 3.34Å; G1343-N1347 PolarHBondContact O-N 2.86Å
1344	I	94.3	Very high	94.3	Very high	87 Å²	87	40.7 Å²	40.7	45%	0.446	21%	0.213	S	C	.	.	H	α-helix	trans	-63.7	-43.3	175.7	-59.7	178.2	0	0	0	110.1	M1274 N1341 N1347 H1348	M1274-I1344 HydrophobicContact CE-CG2 4.42Å; M1274-I1344 HydrophobicContact CG-CG2 3.66Å; M1274-I1344 HydrophobicContact SD-CG2 3.93Å; N1341-I1344 HydrophobicContact CB-CB 4.3Å; N1341-I1344 HydrophobicContact CB-CD1 4.06Å; N1341-I1344 HydrophobicContact CB-CG1 4.17Å; N1341-I1344 PolarHBondContact O-N 3.41Å; N1341-I1344 VanDerWaalsContact O-N 3.14Å; N1341-I1344 PolarHBondContact OD1-N 2.86Å; I1344-N1347 PolarHBondContact O-N 3.39Å; I1344-H1348 VanDerWaalsContact O-CB 3.29Å; I1344-H1348 WeakPolarHBondContact O-CB 3.49Å; I1344-H1348 PolarHBondContact O-N 2.97Å
1345	L	95.3	Very high	93.9	Very high	0 Å²	0	44 Å²	44	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-54.8	-56.5	175.9	179.7	168.2	0	0	0	111.4	T1332 M1335 I1336 V1340 N1341 G1343 N1347 H1348 V1349 L1370	T1332-L1345 HydrophobicContact CG2-CD2 4.2Å; M1335-L1345 HydrophobicContact CB-CD1 3.48Å; M1335-L1345 VanDerWaalsContact CB-CD1 3.48Å; M1335-L1345 HydrophobicContact CB-CG 3.98Å; M1335-L1345 HydrophobicContact CE-CB 4.1Å; M1335-L1345 HydrophobicContact CE-CG 3.9Å; M1335-L1345 HydrophobicContact SD-CG 4.15Å; I1336-L1345 HydrophobicContact CG1-CD1 3.74Å; V1340-L1345 HydrophobicContact CG1-CB 4.28Å; N1341-L1345 WeakPolarHBondContact O-CB 3.49Å; N1341-L1345 PolarHBondContact O-N 3.37Å; G1343-L1345 VanDerWaalsContact C-N 3.34Å; L1345-N1347 VanDerWaalsContact C-N 3.33Å; L1345-N1347 PolarHBondContact O-N 3.27Å; L1345-H1348 PolarHBondContact O-N 3.39Å; L1345-H1348 VanDerWaalsContact O-N 3.08Å; L1345-V1349 HydrophobicContact CD2-CG2 4.16Å; L1345-V1349 WeakPolarHBondContact O-CG2 3.22Å; L1345-V1349 PolarHBondContact O-N 2.98Å; L1345-L1370 HydrophobicContact CD2-CD2 3.84Å
1346	V	96.1	Very high	93.7	Very high	27 Å²	27	44 Å²	44	16%	0.164	23%	0.226	C	C	.	.	H	α-helix	trans	-59.7	-44.3	-177.5	171	0	0	0	0	111.1	K1342 H1348 R1350 L1370 V1373	K1342-V1346 WeakPolarHBondContact O-CG2 3.29Å; K1342-V1346 PolarHBondContact O-N 3.08Å; K1342-V1346 VanDerWaalsContact O-N 3.09Å; V1346-H1348 VanDerWaalsContact C-N 3.3Å; V1346-H1348 PolarHBondContact O-N 3.02Å; V1346-R1350 HydrophobicContact CG1-CG 4.4Å; V1346-R1350 WeakPolarHBondContact O-CB 3.42Å; V1346-R1350 WeakPolarHBondContact O-CG 3.46Å; V1346-R1350 PolarHBondContact O-N 3.3Å; V1346-L1370 HydrophobicContact CG2-CD2 4.26Å; V1346-V1373 HydrophobicContact CG2-CB 4.34Å; V1346-V1373 HydrophobicContact CG2-CG1 4.49Å; V1346-V1373 HydrophobicContact CG2-CG2 4.32Å
1347	N	95.1	Very high	93.3	Very high	61 Å²	61	50.8 Å²	50.8	33%	0.326	25%	0.251	S	S	.	.	H	α-helix	trans	-66.3	-30.7	177.7	-71.9	-6.9	0	0	0	113.1	Y1165 G1343 I1344 L1345 R1351	Y1165-N1347 PolarHBondContact OH-ND2 3.35Å; G1343-N1347 PolarHBondContact O-N 2.86Å; I1344-N1347 PolarHBondContact O-N 3.39Å; L1345-N1347 VanDerWaalsContact C-N 3.33Å; L1345-N1347 PolarHBondContact O-N 3.27Å; N1347-R1351 WeakPolarHBondContact O-CG 3.36Å; N1347-R1351 PolarHBondContact O-NE 2.89Å
1348	H	95.1	Very high	93.1	Very high	8 Å²	8	51.6 Å²	51.6	4%	0.037	26%	0.255	C	S	.	.	H	α-helix	trans	-76.1	-51.7	177.5	-172.9	60	0	0	0	111.3	M1274 E1278 I1344 L1345 V1346 R1350 R1351 L1352	M1274-H1348 HydrophobicContact CG-CB 4.36Å; M1274-H1348 PolarHBondContact O-NE2 3.48Å; M1274-H1348 HydrophobicContact SD-CB 3.9Å; E1278-H1348 IonicContact OE2-CE1 2.82Å; I1344-H1348 VanDerWaalsContact O-CB 3.29Å; I1344-H1348 WeakPolarHBondContact O-CB 3.49Å; I1344-H1348 PolarHBondContact O-N 2.97Å; L1345-H1348 PolarHBondContact O-N 3.39Å; L1345-H1348 VanDerWaalsContact O-N 3.08Å; V1346-H1348 VanDerWaalsContact C-N 3.3Å; V1346-H1348 PolarHBondContact O-N 3.02Å; H1348-R1350 PolarHBondContact O-N 3.36Å; H1348-R1351 PolarHBondContact O-N 2.94Å; H1348-R1351 VanDerWaalsContact O-N 3.1Å; H1348-L1352 PolarHBondContact O-N 2.97Å
1349	V	96	Very high	92.7	Very high	0 Å²	0	52.4 Å²	52.4	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-64.3	-38.1	-179.4	-176.1	0	0	0	0	111.6	L1328 T1332 M1335 L1345 R1351 L1352 L1353 T1366 L1370	L1328-V1349 HydrophobicContact CD2-CG1 4.5Å; T1332-V1349 WeakPolarHBondContact OG1-CG1 3.39Å; M1335-V1349 HydrophobicContact SD-CG2 3.9Å; L1345-V1349 HydrophobicContact CD2-CG2 4.16Å; L1345-V1349 WeakPolarHBondContact O-CG2 3.22Å; L1345-V1349 PolarHBondContact O-N 2.98Å; V1349-R1351 VanDerWaalsContact C-N 3.3Å; V1349-R1351 PolarHBondContact O-N 2.93Å; V1349-L1352 PolarHBondContact O-N 3.13Å; V1349-L1353 WeakPolarHBondContact O-CB 3.14Å; V1349-L1353 PolarHBondContact O-N 3.1Å; V1349-T1366 HydrophobicContact CG1-CG2 4.11Å; V1349-L1370 HydrophobicContact CB-CD1 4.03Å; V1349-L1370 HydrophobicContact CB-CD2 3.93Å; V1349-L1370 HydrophobicContact CG1-CD1 3.82Å; V1349-L1370 HydrophobicContact CG1-CD2 4.06Å; V1349-L1370 HydrophobicContact CG1-CG 4.4Å; V1349-L1370 HydrophobicContact CG2-CD2 4.38Å
1350	R	94.8	Very high	92.5	Very high	104 Å²	104	51.7 Å²	51.7	39%	0.392	27%	0.266	S	S	.	.	H	α-helix	trans	-60.9	-36.3	173.7	-74.1	-170.8	-169.4	-103.5	-2.8	113	V1346 H1348 A1354 L1370 D1371	V1346-R1350 HydrophobicContact CG1-CG 4.4Å; V1346-R1350 WeakPolarHBondContact O-CB 3.42Å; V1346-R1350 WeakPolarHBondContact O-CG 3.46Å; V1346-R1350 PolarHBondContact O-N 3.3Å; H1348-R1350 PolarHBondContact O-N 3.36Å; R1350-A1354 WeakPolarHBondContact O-CB 3.41Å; R1350-A1354 PolarHBondContact O-N 3.49Å; R1350-L1370 HydrophobicContact CG-CD1 3.8Å; R1350-D1371 IonicContact CZ-OD1 3.73Å; R1350-D1371 IonicContact NH2-OD1 3.18Å; R1350-D1371 PolarHBondContact NH2-OD1 3.09Å
1351	R	93.4	Very high	92.2	Very high	162 Å²	162	54.3 Å²	54.3	61%	0.611	28%	0.276	S	S	*	.	H	α-helix	trans	-69.8	-40.8	175.7	-78.9	178.7	-71.1	-177	2.1	112.1	N1347 H1348 V1349 A1354 R1355	N1347-R1351 WeakPolarHBondContact O-CG 3.36Å; N1347-R1351 PolarHBondContact O-NE 2.89Å; H1348-R1351 PolarHBondContact O-N 2.94Å; H1348-R1351 VanDerWaalsContact O-N 3.1Å; V1349-R1351 VanDerWaalsContact C-N 3.3Å; V1349-R1351 PolarHBondContact O-N 2.93Å; R1351-A1354 PolarHBondContact O-N 2.88Å; R1351-R1355 WeakPolarHBondContact O-CB 3.48Å; R1351-R1355 PolarHBondContact O-N 3.04Å
1352	L	93.5	Very high	92	Very high	3 Å²	3	49.8 Å²	49.8	2%	0.016	25%	0.252	C	S	.	.	H	α-helix	trans	-63.6	-43.1	172.9	-66.8	176.7	0	0	0	111.5	E1278 F1281 F1282 L1328 L1331 H1348 V1349 A1354 R1355 C1356	E1278-L1352 HydrophobicContact CG-CD2 4.09Å; F1281-L1352 HydrophobicContact CD1-CD1 4.34Å; F1281-L1352 HydrophobicContact CD1-CD2 4.37Å; F1282-L1352 HydrophobicContact CE1-CD2 4.1Å; F1282-L1352 HydrophobicContact CZ-CD2 3.94Å; L1328-L1352 HydrophobicContact CD2-CB 3.81Å; L1328-L1352 HydrophobicContact CD2-CD1 4.18Å; L1331-L1352 HydrophobicContact CD2-CD1 4.2Å; H1348-L1352 PolarHBondContact O-N 2.97Å; V1349-L1352 PolarHBondContact O-N 3.13Å; L1352-A1354 PolarHBondContact O-N 3.16Å; L1352-R1355 PolarHBondContact O-N 2.62Å; L1352-C1356 WeakPolarHBondContact O-CB 3.3Å; L1352-C1356 PolarHBondContact O-N 2.76Å; L1352-C1356 PolarHBondContact O-SG 2.99Å
1353	L	93.1	Very high	91.9	Very high	18 Å²	18	47.8 Å²	47.8	9%	0.094	25%	0.246	C	C	.	.	H	α-helix	trans	-56.9	-47.9	176.3	-167.7	78.6	0	0	0	111.4	L1328 V1349 C1356 R1357 I1358 A1363 T1366	L1328-L1353 HydrophobicContact CD1-CB 4.33Å; L1328-L1353 HydrophobicContact CD1-CD1 3.76Å; V1349-L1353 WeakPolarHBondContact O-CB 3.14Å; V1349-L1353 PolarHBondContact O-N 3.1Å; L1353-C1356 PolarHBondContact O-N 3.03Å; L1353-R1357 PolarHBondContact O-N 2.87Å; L1353-I1358 HydrophobicContact CD1-CD1 3.93Å; L1353-A1363 HydrophobicContact CD2-CB 4.39Å; L1353-T1366 HydrophobicContact CD1-CG2 4.13Å
1354	A	91	Very high	91.8	Very high	71 Å²	71	48.5 Å²	48.5	59%	0.587	25%	0.248	S	C	*	.	H	α-helix	trans	-63.4	-43.6	175.8	0	0	0	0	0	112.3	R1350 R1351 L1352 C1356 R1357	R1350-A1354 WeakPolarHBondContact O-CB 3.41Å; R1350-A1354 PolarHBondContact O-N 3.49Å; R1351-A1354 PolarHBondContact O-N 2.88Å; L1352-A1354 PolarHBondContact O-N 3.16Å; A1354-C1356 VanDerWaalsContact C-N 3.27Å; A1354-C1356 PolarHBondContact O-N 2.9Å; A1354-R1357 PolarHBondContact O-N 2.93Å; A1354-R1357 VanDerWaalsContact O-N 3.16Å
1355	R	88.9	Confident	91.4	Very high	74 Å²	74	46.9 Å²	46.9	28%	0.279	24%	0.24	S	C	.	.	H	α-helix	trans	-63.6	-31.9	177.2	-167.9	170.3	-177.4	127.5	2.6	112.3	I460 V467 V468 E496 R1351 L1352 R1357	I460-R1355 HydrophobicContact CD1-CG 4.43Å; V467-R1355 WeakPolarHBondContact CG1-O 3.4Å; V468-R1355 PolarHBondContact O-NH2 3.39Å; V468-R1355 VanDerWaalsContact O-NH2 3.1Å; E496-R1355 IonicContact OE1-CZ 3.85Å; E496-R1355 VanDerWaalsContact OE1-CZ 3.24Å; E496-R1355 IonicContact OE1-NH1 2.7Å; E496-R1355 PolarHBondContact OE1-NH1 2.73Å; E496-R1355 IonicContact OE1-NH2 3.22Å; E496-R1355 PolarHBondContact OE1-NH2 2.87Å; E496-R1355 IonicContact OE2-NH1 3.09Å; R1351-R1355 WeakPolarHBondContact O-CB 3.48Å; R1351-R1355 PolarHBondContact O-N 3.04Å; L1352-R1355 PolarHBondContact O-N 2.62Å; R1355-R1357 VanDerWaalsContact C-N 3.3Å; R1355-R1357 PolarHBondContact O-N 3.41Å
1356	C	90.9	Very high	91.2	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-74.3	-14.6	176.9	-65.9	0	0	0	0	114.5	I460 F1281 L1324 L1352 L1353 A1354 I1358	I460-C1356 HydrophobicContact CG2-CB 4.47Å; F1281-C1356 VanDerWaalsContact CE1-SG 3.6Å; F1281-C1356 VanDerWaalsContact CZ-SG 3.6Å; L1324-C1356 HydrophobicContact CD1-CB 4.24Å; L1352-C1356 WeakPolarHBondContact O-CB 3.3Å; L1352-C1356 PolarHBondContact O-N 2.76Å; L1352-C1356 PolarHBondContact O-SG 2.99Å; L1353-C1356 PolarHBondContact O-N 3.03Å; A1354-C1356 VanDerWaalsContact C-N 3.27Å; A1354-C1356 PolarHBondContact O-N 2.9Å; C1356-I1358 VanDerWaalsContact C-N 3.31Å; C1356-I1358 HydrophobicContact CB-CD1 3.66Å; C1356-I1358 HydrophobicContact CB-CG1 3.69Å; C1356-I1358 PolarHBondContact O-N 3.39Å
1357	R	88.3	Confident	91	Very high	151 Å²	151	46.9 Å²	46.9	57%	0.57	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	47.1	50.1	-176.7	-61.5	-176.6	177.7	139.8	2.8	112.8	R461 L1353 A1354 R1355	R461-R1357 PolarHBondContact NH1-O 2.97Å; L1353-R1357 PolarHBondContact O-N 2.87Å; A1354-R1357 PolarHBondContact O-N 2.93Å; A1354-R1357 VanDerWaalsContact O-N 3.16Å; R1355-R1357 VanDerWaalsContact C-N 3.3Å; R1355-R1357 PolarHBondContact O-N 3.41Å
1358	I	89.1	Confident	90.9	Very high	16 Å²	16	49.4 Å²	49.4	8%	0.082	25%	0.246	C	C	.	.			trans	-77.7	136.6	-176.6	-66.2	160.7	0	0	0	110.1	D1321 L1324 A1325 L1328 L1353 C1356 F1362 A1363	D1321-I1358 HydrophobicContact CB-CG2 4.19Å; D1321-I1358 VanDerWaalsContact OD1-CA 3.28Å; D1321-I1358 WeakPolarHBondContact OD1-CA 3.36Å; L1324-I1358 HydrophobicContact CB-CD1 3.7Å; L1324-I1358 HydrophobicContact CB-CG1 3.91Å; L1324-I1358 HydrophobicContact CD1-CG1 4.37Å; A1325-I1358 HydrophobicContact CB-CG2 4.42Å; L1328-I1358 HydrophobicContact CD1-CD1 3.74Å; L1353-I1358 HydrophobicContact CD1-CD1 3.93Å; C1356-I1358 VanDerWaalsContact C-N 3.31Å; C1356-I1358 HydrophobicContact CB-CD1 3.66Å; C1356-I1358 HydrophobicContact CB-CG1 3.69Å; C1356-I1358 PolarHBondContact O-N 3.39Å; I1358-F1362 HydrophobicContact CG2-CB 3.5Å; I1358-A1363 HydrophobicContact CB-CB 4.42Å; I1358-A1363 HydrophobicContact CG2-CB 4.25Å
1359	G	86	Confident	90.7	Very high	18 Å²	18	49.5 Å²	49.5	19%	0.186	25%	0.247	C	C	.	.			trans	-57.7	145.7	177.8	0	0	0	0	0	113.6	D1321 Y1361 F1362 A1363	D1321-G1359 PolarHBondContact OD1-N 2.88Å; G1359-Y1361 PolarHBondContact O-N 3.37Å; G1359-Y1361 VanDerWaalsContact O-N 3.12Å; G1359-F1362 PolarHBondContact O-N 3.45Å; G1359-A1363 PolarHBondContact O-N 3.17Å
1360	S	87.2	Confident	90.5	Very high	82 Å²	82	49.7 Å²	49.7	57%	0.573	25%	0.248	S	C	*	.	H	α-helix	trans	-44.4	-48.8	-168.7	56.5	0	0	0	0	115.1	F1362 A1363 A1364	S1360-F1362 PolarHBondContact O-N 2.73Å; S1360-A1363 PolarHBondContact O-N 2.91Å; S1360-A1364 WeakPolarHBondContact O-CB 3.4Å; S1360-A1364 PolarHBondContact O-N 3.3Å
1361	Y	88	Confident	90.4	Very high	60 Å²	60	49.3 Å²	49.3	24%	0.235	25%	0.254	C	S	.	.	H	α-helix	trans	-55.7	-50.9	178.1	173.9	-103.1	0	0	0	112.9	G1359 A1364 I1365 G1425 E1426	G1359-Y1361 PolarHBondContact O-N 3.37Å; G1359-Y1361 VanDerWaalsContact O-N 3.12Å; Y1361-A1364 PolarHBondContact O-N 3.06Å; Y1361-I1365 HydrophobicContact CE1-CD1 4.06Å; Y1361-G1425 WeakPolarHBondContact CD1-O 3.44Å; Y1361-G1425 WeakPolarHBondContact CE1-O 3.39Å; Y1361-E1426 HydrophobicContact CD2-CB 4.14Å; Y1361-E1426 HydrophobicContact CD2-CG 3.43Å; Y1361-E1426 VanDerWaalsContact CD2-CG 3.43Å; Y1361-E1426 HydrophobicContact CE2-CB 4.27Å; Y1361-E1426 HydrophobicContact CE2-CG 3.97Å; Y1361-E1426 HydrophobicContact CG-CG 4.14Å
1362	F	88.5	Confident	90.3	Very high	4 Å²	4	43.3 Å²	43.3	2%	0.018	23%	0.234	C	C	.	.	H	α-helix	trans	-73.9	-34	-178.6	-75.9	-69.1	0	0	0	111.9	L1318 D1321 R1322 A1325 I1358 G1359 S1360 A1364 I1365	L1318-F1362 HydrophobicContact CB-CE2 4.45Å; L1318-F1362 HydrophobicContact CD2-CD2 4.26Å; L1318-F1362 HydrophobicContact CD2-CE2 3.77Å; D1321-F1362 HydrophobicContact CB-CB 4.28Å; D1321-F1362 HydrophobicContact CB-CD2 3.46Å; D1321-F1362 VanDerWaalsContact CB-CD2 3.46Å; D1321-F1362 HydrophobicContact CB-CE2 4.04Å; D1321-F1362 HydrophobicContact CB-CG 4.1Å; R1322-F1362 HydrophobicContact CB-CD1 4.49Å; R1322-F1362 HydrophobicContact CB-CE1 3.83Å; R1322-F1362 HydrophobicContact CB-CE2 4.35Å; R1322-F1362 HydrophobicContact CB-CZ 3.75Å; R1322-F1362 HydrophobicContact CG-CE1 4.04Å; R1322-F1362 HydrophobicContact CG-CZ 4.28Å; A1325-F1362 HydrophobicContact CB-CB 3.86Å; A1325-F1362 HydrophobicContact CB-CD1 4.25Å; A1325-F1362 HydrophobicContact CB-CG 4.42Å; I1358-F1362 HydrophobicContact CG2-CB 3.5Å; G1359-F1362 PolarHBondContact O-N 3.45Å; S1360-F1362 PolarHBondContact O-N 2.73Å; F1362-A1364 VanDerWaalsContact C-N 3.3Å; F1362-A1364 PolarHBondContact O-N 3.38Å; F1362-I1365 HydrophobicContact CD1-CD1 4.03Å; F1362-I1365 PolarHBondContact O-N 3.32Å
1363	A	91.4	Very high	90.1	Very high	17 Å²	17	43.3 Å²	43.3	14%	0.14	23%	0.234	C	C	.	.	H	α-helix	trans	-65.3	-33.1	173.7	0	0	0	0	0	112.6	L1353 I1358 G1359 S1360 S1367	L1353-A1363 HydrophobicContact CD2-CB 4.39Å; I1358-A1363 HydrophobicContact CB-CB 4.42Å; I1358-A1363 HydrophobicContact CG2-CB 4.25Å; G1359-A1363 PolarHBondContact O-N 3.17Å; S1360-A1363 PolarHBondContact O-N 2.91Å; A1363-S1367 VanDerWaalsContact O-CB 3.3Å; A1363-S1367 WeakPolarHBondContact O-CB 3.06Å; A1363-S1367 PolarHBondContact O-N 3.45Å; A1363-S1367 PolarHBondContact O-OG 2.95Å
1364	A	91	Very high	89.9	Confident	55 Å²	55	50.5 Å²	50.5	46%	0.455	26%	0.264	S	S	.	.	H	α-helix	trans	-66.6	-33.2	176.7	0	0	0	0	0	112.9	S1360 Y1361 F1362 S1367 R1368	S1360-A1364 WeakPolarHBondContact O-CB 3.4Å; S1360-A1364 PolarHBondContact O-N 3.3Å; Y1361-A1364 PolarHBondContact O-N 3.06Å; F1362-A1364 VanDerWaalsContact C-N 3.3Å; F1362-A1364 PolarHBondContact O-N 3.38Å; A1364-S1367 PolarHBondContact O-N 2.93Å; A1364-R1368 VanDerWaalsContact O-CB 3.27Å; A1364-R1368 WeakPolarHBondContact O-CB 3.36Å; A1364-R1368 PolarHBondContact O-N 3.27Å
1365	I	87.6	Confident	89.8	Confident	53 Å²	53	54.5 Å²	54.5	27%	0.272	27%	0.265	S	S	.	.	H	α-helix	trans	-60.2	-52.9	175.9	-60.4	171.8	0	0	0	110	Y1329 Y1361 F1362 L1369	Y1329-I1365 HydrophobicContact CD2-CG2 4.04Å; Y1329-I1365 HydrophobicContact CE2-CG2 4.28Å; Y1361-I1365 HydrophobicContact CE1-CD1 4.06Å; F1362-I1365 HydrophobicContact CD1-CD1 4.03Å; F1362-I1365 PolarHBondContact O-N 3.32Å; I1365-L1369 PolarHBondContact O-N 3.01Å
1366	T	89.9	Confident	89.8	Confident	0 Å²	0	51.7 Å²	51.7	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-68.1	-38.2	178.5	-49.5	0	0	0	0	111.6	L1328 V1349 L1353 L1369 L1370	L1328-T1366 HydrophobicContact CB-CG2 4.27Å; V1349-T1366 HydrophobicContact CG1-CG2 4.11Å; L1353-T1366 HydrophobicContact CD1-CG2 4.13Å; T1366-L1369 WeakPolarHBondContact O-CB 3.13Å; T1366-L1369 PolarHBondContact O-N 3.3Å; T1366-L1370 HydrophobicContact CG2-CD1 4.38Å; T1366-L1370 VanDerWaalsContact O-CG 3.32Å; T1366-L1370 WeakPolarHBondContact O-CG 3.41Å; T1366-L1370 PolarHBondContact O-N 3.45Å
1367	S	92.6	Very high	89.6	Confident	28 Å²	28	56 Å²	56	20%	0.196	28%	0.279	C	S	.	.	H	α-helix	trans	-64.2	-45.5	178.7	-60.2	0	0	0	0	112.3	A1363 A1364 L1369 L1370 D1371	A1363-S1367 VanDerWaalsContact O-CB 3.3Å; A1363-S1367 WeakPolarHBondContact O-CB 3.06Å; A1363-S1367 PolarHBondContact O-N 3.45Å; A1363-S1367 PolarHBondContact O-OG 2.95Å; A1364-S1367 PolarHBondContact O-N 2.93Å; S1367-L1369 VanDerWaalsContact C-N 3.27Å; S1367-L1369 PolarHBondContact O-N 2.92Å; S1367-L1370 WeakPolarHBondContact O-CA 3.44Å; S1367-L1370 WeakPolarHBondContact O-CB 3.29Å; S1367-L1370 PolarHBondContact O-N 3.03Å; S1367-D1371 VanDerWaalsContact O-CG 3.3Å; S1367-D1371 PolarHBondContact O-N 3.32Å
1368	R	91.6	Very high	89.6	Confident	113 Å²	113	49.4 Å²	49.4	43%	0.426	26%	0.258	S	S	.	.	H	α-helix	trans	-61.3	-35	174.8	-178.5	176.9	177.2	169.8	0.2	112	A1209 S1210 A1364 N1372	A1209-R1368 PolarHBondContact O-NE 3.34Å; S1210-R1368 PolarHBondContact OG-NH2 3.07Å; A1364-R1368 VanDerWaalsContact O-CB 3.27Å; A1364-R1368 WeakPolarHBondContact O-CB 3.36Å; A1364-R1368 PolarHBondContact O-N 3.27Å; R1368-N1372 PolarHBondContact O-N 3.34Å; R1368-N1372 PolarHBondContact O-ND2 2.91Å
1369	L	91.2	Very high	89.6	Confident	10 Å²	10	49 Å²	49	5%	0.052	26%	0.256	C	S	.	.	H	α-helix	trans	-62.4	-49.6	170.9	-178.6	65.9	0	0	0	110.5	Y1329 T1332 I1365 T1366 S1367 D1371 N1372 V1373 L1376 I1381	Y1329-L1369 HydrophobicContact CD2-CD2 3.76Å; Y1329-L1369 HydrophobicContact CE2-CB 4.45Å; Y1329-L1369 HydrophobicContact CE2-CD2 3.83Å; Y1329-L1369 HydrophobicContact CE2-CG 4.5Å; Y1329-L1369 HydrophobicContact CG-CD2 4.24Å; T1332-L1369 HydrophobicContact CG2-CD2 3.61Å; T1332-L1369 HydrophobicContact CG2-CG 4.12Å; I1365-L1369 PolarHBondContact O-N 3.01Å; T1366-L1369 WeakPolarHBondContact O-CB 3.13Å; T1366-L1369 PolarHBondContact O-N 3.3Å; S1367-L1369 VanDerWaalsContact C-N 3.27Å; S1367-L1369 PolarHBondContact O-N 2.92Å; L1369-D1371 VanDerWaalsContact C-N 3.35Å; L1369-D1371 PolarHBondContact O-N 3.21Å; L1369-N1372 PolarHBondContact O-N 3.42Å; L1369-N1372 VanDerWaalsContact O-N 3.14Å; L1369-V1373 WeakPolarHBondContact O-CG2 3.48Å; L1369-V1373 PolarHBondContact O-N 3.2Å; L1369-L1376 HydrophobicContact CD1-CD1 3.65Å; L1369-I1381 HydrophobicContact CD1-CD1 3.85Å; L1369-I1381 HydrophobicContact CD1-CG1 3.98Å; L1369-I1381 HydrophobicContact CD1-CG2 4.17Å; L1369-I1381 HydrophobicContact CD2-CG2 4.48Å
1370	L	92.9	Very high	89.7	Confident	5 Å²	5	49.4 Å²	49.4	3%	0.026	26%	0.256	C	S	.	.	H	α-helix	trans	-61	-36.8	-179	-68.7	175.8	0	0	0	113.8	T1332 L1345 V1346 V1349 R1350 T1366 S1367 N1372 V1373	T1332-L1370 HydrophobicContact CG2-CD2 3.77Å; L1345-L1370 HydrophobicContact CD2-CD2 3.84Å; V1346-L1370 HydrophobicContact CG2-CD2 4.26Å; V1349-L1370 HydrophobicContact CB-CD1 4.03Å; V1349-L1370 HydrophobicContact CB-CD2 3.93Å; V1349-L1370 HydrophobicContact CG1-CD1 3.82Å; V1349-L1370 HydrophobicContact CG1-CD2 4.06Å; V1349-L1370 HydrophobicContact CG1-CG 4.4Å; V1349-L1370 HydrophobicContact CG2-CD2 4.38Å; R1350-L1370 HydrophobicContact CG-CD1 3.8Å; T1366-L1370 HydrophobicContact CG2-CD1 4.38Å; T1366-L1370 VanDerWaalsContact O-CG 3.32Å; T1366-L1370 WeakPolarHBondContact O-CG 3.41Å; T1366-L1370 PolarHBondContact O-N 3.45Å; S1367-L1370 WeakPolarHBondContact O-CA 3.44Å; S1367-L1370 WeakPolarHBondContact O-CB 3.29Å; S1367-L1370 PolarHBondContact O-N 3.03Å; L1370-N1372 VanDerWaalsContact C-N 3.27Å; L1370-N1372 PolarHBondContact O-N 2.83Å; L1370-V1373 HydrophobicContact CD2-CG2 4.33Å; L1370-V1373 WeakPolarHBondContact O-CG2 3.42Å; L1370-V1373 PolarHBondContact O-N 2.99Å
1371	D	91.9	Very high	89.9	Confident	96 Å²	96	45.8 Å²	45.8	51%	0.513	23%	0.23	S	C	.	.	H	α-helix	trans	-65.8	-31.3	176.9	-64.3	-33.8	0	0	0	112.3	R1350 S1367 L1369	R1350-D1371 IonicContact CZ-OD1 3.73Å; R1350-D1371 IonicContact NH2-OD1 3.18Å; R1350-D1371 PolarHBondContact NH2-OD1 3.09Å; S1367-D1371 VanDerWaalsContact O-CG 3.3Å; S1367-D1371 PolarHBondContact O-N 3.32Å; L1369-D1371 VanDerWaalsContact C-N 3.35Å; L1369-D1371 PolarHBondContact O-N 3.21Å
1372	N	91.3	Very high	90.1	Very high	36 Å²	36	44.2 Å²	44.2	19%	0.193	23%	0.226	C	C	.	.	H	α-helix	trans	-91.6	-4.2	-177.6	-73.1	-74.7	0	0	0	114.5	A1209 R1368 L1369 L1370 K1374 Y1375 L1376	A1209-N1372 PolarHBondContact O-ND2 3.32Å; R1368-N1372 PolarHBondContact O-N 3.34Å; R1368-N1372 PolarHBondContact O-ND2 2.91Å; L1369-N1372 PolarHBondContact O-N 3.42Å; L1369-N1372 VanDerWaalsContact O-N 3.14Å; L1370-N1372 VanDerWaalsContact C-N 3.27Å; L1370-N1372 PolarHBondContact O-N 2.83Å; N1372-K1374 PolarHBondContact O-N 2.96Å; N1372-Y1375 PolarHBondContact O-N 3.01Å; N1372-L1376 HydrophobicContact CB-CD1 4.27Å
1373	V	90	Very high	90.3	Very high	2 Å²	2	44 Å²	44	1%	0.012	23%	0.225	C	C	.	.	G	3₁₀ helix	trans	-52.3	-28.9	-175	173.2	0	0	0	0	114	I1336 K1342 V1346 L1369 L1370 Y1375 L1376	I1336-V1373 HydrophobicContact CD1-CG1 4.08Å; I1336-V1373 HydrophobicContact CD1-CG2 3.99Å; I1336-V1373 HydrophobicContact CG1-CG1 4.32Å; K1342-V1373 HydrophobicContact CB-CG1 3.94Å; K1342-V1373 HydrophobicContact CD-CG1 4Å; K1342-V1373 WeakPolarHBondContact CD-O 3.47Å; K1342-V1373 HydrophobicContact CG-CG1 3.89Å; K1342-V1373 PolarHBondContact NZ-O 3.22Å; K1342-V1373 VanDerWaalsContact NZ-O 3.12Å; V1346-V1373 HydrophobicContact CG2-CB 4.34Å; V1346-V1373 HydrophobicContact CG2-CG1 4.49Å; V1346-V1373 HydrophobicContact CG2-CG2 4.32Å; L1369-V1373 WeakPolarHBondContact O-CG2 3.48Å; L1369-V1373 PolarHBondContact O-N 3.2Å; L1370-V1373 HydrophobicContact CD2-CG2 4.33Å; L1370-V1373 WeakPolarHBondContact O-CG2 3.42Å; L1370-V1373 PolarHBondContact O-N 2.99Å; V1373-Y1375 PolarHBondContact O-N 2.79Å; V1373-Y1375 VanDerWaalsContact O-N 3.15Å; V1373-L1376 PolarHBondContact O-N 3.29Å
1374	K	88.6	Confident	90.2	Very high	169 Å²	169	44.3 Å²	44.3	74%	0.735	22%	0.224	S	C	*	.	G	3₁₀ helix	trans	-55.2	-31.2	175.6	-66.1	179.3	-176.4	172.1	0	112.9	N1372	N1372-K1374 PolarHBondContact O-N 2.96Å
1375	Y	88	Confident	90.1	Very high	155 Å²	155	41.7 Å²	41.7	61%	0.608	20%	0.203	S	C	*	.	G	3₁₀ helix	trans	-105	2.7	-175.8	-48.8	-70.3	0	0	0	114.1	N1372 V1373	N1372-Y1375 PolarHBondContact O-N 3.01Å; V1373-Y1375 PolarHBondContact O-N 2.79Å; V1373-Y1375 VanDerWaalsContact O-N 3.15Å
1376	L	89.7	Confident	90.1	Very high	16 Å²	16	40.4 Å²	40.4	8%	0.084	20%	0.198	C	C	.	.			trans	-111.5	129.6	-176.7	-59.2	171.4	0	0	0	109.8	I1336 K1342 L1369 N1372 V1373 I1381	I1336-L1376 HydrophobicContact CD1-CB 4.44Å; K1342-L1376 PolarHBondContact NZ-O 2.87Å; L1369-L1376 HydrophobicContact CD1-CD1 3.65Å; N1372-L1376 HydrophobicContact CB-CD1 4.27Å; V1373-L1376 PolarHBondContact O-N 3.29Å; L1376-I1381 HydrophobicContact CB-CD1 4.39Å; L1376-I1381 HydrophobicContact CD1-CD1 4.05Å; L1376-I1381 HydrophobicContact CD1-CG1 4.09Å; L1376-I1381 HydrophobicContact CD2-CG1 4.46Å
1377	D	87.6	Confident	90	Very high	89 Å²	89	41.3 Å²	41.3	48%	0.476	20%	0.202	S	C	.	.			trans	-142.8	151.6	179.1	-73.1	-59.8	0	0	0	110.9	K1342 N1379 S1380	K1342-D1377 WeakPolarHBondContact CE-OD1 3.5Å; K1342-D1377 IonicContact NZ-OD1 3.61Å; K1342-D1377 PolarHBondContact NZ-OD1 3.48Å; K1342-D1377 IonicContact NZ-OD2 3.03Å; K1342-D1377 PolarHBondContact NZ-OD2 3.43Å; D1377-N1379 PolarHBondContact O-N 3.29Å; D1377-S1380 VanDerWaalsContact O-CB 3.31Å; D1377-S1380 WeakPolarHBondContact O-CB 3.21Å; D1377-S1380 PolarHBondContact O-N 3.34Å; D1377-S1380 PolarHBondContact O-OG 2.64Å
1378	G	87.3	Confident	89.7	Confident	13 Å²	13	42.4 Å²	42.4	13%	0.134	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	58.8	-134.1	178.2	0	0	0	0	0	113	Y1258 S1380	Y1258-G1378 WeakPolarHBondContact OH-CA 3.48Å; G1378-S1380 VanDerWaalsContact C-N 3.32Å; G1378-S1380 PolarHBondContact O-N 2.9Å
1379	N	89.2	Confident	89.6	Confident	7 Å²	7	38.1 Å²	38.1	4%	0.037	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.5	35.7	178.6	68.3	-18.5	0	0	0	113.9	H1068 Y1256 Y1258 L1337 D1377 I1381	H1068-N1379 WeakPolarHBondContact NE2-CA 3.28Å; Y1256-N1379 WeakPolarHBondContact CD1-ND2 3.23Å; Y1256-N1379 WeakPolarHBondContact CD2-ND2 3.33Å; Y1256-N1379 WeakPolarHBondContact CE1-ND2 3.2Å; Y1256-N1379 VanDerWaalsContact CE2-ND2 3.3Å; Y1256-N1379 WeakPolarHBondContact CE2-ND2 3.38Å; Y1258-N1379 HydrophobicContact CE1-CB 3.87Å; L1337-N1379 HydrophobicContact CD1-CB 3.7Å; D1377-N1379 PolarHBondContact O-N 3.29Å; N1379-I1381 PolarHBondContact O-N 2.88Å
1380	S	88.3	Confident	89.1	Confident	27 Å²	27	38.2 Å²	38.2	19%	0.189	19%	0.192	C	C	.	.			trans	-73.9	0.7	-179.5	-61.7	0	0	0	0	114.7	D1377 G1378	D1377-S1380 VanDerWaalsContact O-CB 3.31Å; D1377-S1380 WeakPolarHBondContact O-CB 3.21Å; D1377-S1380 PolarHBondContact O-N 3.34Å; D1377-S1380 PolarHBondContact O-OG 2.64Å; G1378-S1380 VanDerWaalsContact C-N 3.32Å; G1378-S1380 PolarHBondContact O-N 2.9Å
1381	I	91.2	Very high	87.9	Confident	6 Å²	6	40.9 Å²	40.9	3%	0.031	20%	0.203	C	C	.	.	S	Bend	trans	-120.3	113.2	-175.3	-60.2	158.7	0	0	0	107.7	H1068 Y1329 A1333 I1336 L1369 L1376 N1379 L1383	H1068-I1381 PolarHBondContact CE1-O 2.73Å; H1068-I1381 PolarHBondContact NE2-O 3.22Å; Y1329-I1381 HydrophobicContact CE1-CG2 3.67Å; Y1329-I1381 WeakPolarHBondContact OH-CG2 3.46Å; A1333-I1381 HydrophobicContact CB-CB 3.93Å; A1333-I1381 HydrophobicContact CB-CD1 4.23Å; A1333-I1381 HydrophobicContact CB-CG2 3.78Å; I1336-I1381 HydrophobicContact CB-CD1 4.41Å; I1336-I1381 HydrophobicContact CD1-CD1 3.43Å; I1336-I1381 VanDerWaalsContact CD1-CD1 3.43Å; I1336-I1381 HydrophobicContact CG1-CD1 4.49Å; L1369-I1381 HydrophobicContact CD1-CD1 3.85Å; L1369-I1381 HydrophobicContact CD1-CG1 3.98Å; L1369-I1381 HydrophobicContact CD1-CG2 4.17Å; L1369-I1381 HydrophobicContact CD2-CG2 4.48Å; L1376-I1381 HydrophobicContact CB-CD1 4.39Å; L1376-I1381 HydrophobicContact CD1-CD1 4.05Å; L1376-I1381 HydrophobicContact CD1-CG1 4.09Å; L1376-I1381 HydrophobicContact CD2-CG1 4.46Å; N1379-I1381 PolarHBondContact O-N 2.88Å; I1381-L1383 PolarHBondContact O-N 2.85Å
1382	D	91.8	Very high	86.7	Confident	27 Å²	27	38.2 Å²	38.2	14%	0.144	19%	0.191	C	C	.	.	P	Polyproline II helix	trans	-67.9	130.5	177.9	-61.3	-53.2	0	0	0	110.4	C1019 K1205 Y1329	C1019-D1382 HydrophobicContact CB-CB 3.79Å; K1205-D1382 WeakPolarHBondContact CB-OD1 3.17Å; K1205-D1382 WeakPolarHBondContact CB-OD2 3.34Å; K1205-D1382 WeakPolarHBondContact CD-OD1 3.29Å; Y1329-D1382 WeakPolarHBondContact CE1-O 3.49Å
1383	L	92.7	Very high	85.3	Confident	1 Å²	1	39.9 Å²	39.9	1%	0.005	20%	0.196	C	C	.	.	P	Polyproline II helix	trans	-75.7	138.5	-175.1	-57.9	172.6	0	0	0	112	C1019 I1020 E1065 H1068 T1069 A1333 Y1334 I1381	C1019-L1383 CarbonylContact C-O 3.53Å; C1019-L1383 VanDerWaalsContact CA-O 3.28Å; C1019-L1383 WeakPolarHBondContact CA-O 3.27Å; C1019-L1383 WeakPolarHBondContact CB-O 3.43Å; I1020-L1383 HydrophobicContact CB-CB 4.25Å; I1020-L1383 HydrophobicContact CD1-CB 3.88Å; I1020-L1383 HydrophobicContact CD1-CD1 4.42Å; I1020-L1383 HydrophobicContact CG1-CB 4.33Å; I1020-L1383 PolarHBondContact N-O 2.62Å; E1065-L1383 HydrophobicContact CG-CD1 4.17Å; H1068-L1383 HydrophobicContact CB-CD1 3.84Å; T1069-L1383 HydrophobicContact CG2-CD1 4.18Å; A1333-L1383 HydrophobicContact CB-CD2 3.76Å; Y1334-L1383 HydrophobicContact CD1-CD2 4.14Å; Y1334-L1383 HydrophobicContact CE1-CD1 3.72Å; Y1334-L1383 HydrophobicContact CE1-CD2 3.5Å; Y1334-L1383 HydrophobicContact CE1-CG 4.26Å; I1381-L1383 PolarHBondContact O-N 2.85Å
1384	L	90.9	Very high	84.6	Confident	23 Å²	23	42.2 Å²	42.2	12%	0.12	21%	0.207	C	C	.	.	P	Polyproline II helix	trans	-80.8	145.2	172.6	-61.7	176.7	0	0	0	110.4	F1326 Y1329 N1330	F1326-L1384 HydrophobicContact CD1-CD1 3.73Å; F1326-L1384 HydrophobicContact CD2-CB 4.19Å; F1326-L1384 HydrophobicContact CE1-CD1 3.86Å; F1326-L1384 HydrophobicContact CE2-CB 4.47Å; F1326-L1384 HydrophobicContact CG-CB 4.34Å; F1326-L1384 HydrophobicContact CG-CD1 4.08Å; F1326-L1384 HydrophobicContact CZ-CD1 4.31Å; Y1329-L1384 HydrophobicContact CD1-CB 4.47Å; Y1329-L1384 HydrophobicContact CD1-CD1 3.64Å; Y1329-L1384 HydrophobicContact CD1-CG 3.72Å; Y1329-L1384 HydrophobicContact CD2-CD1 4.22Å; Y1329-L1384 HydrophobicContact CE1-CD1 4.05Å; Y1329-L1384 HydrophobicContact CE1-CG 3.8Å; Y1329-L1384 HydrophobicContact CG-CD1 3.75Å; Y1329-L1384 HydrophobicContact CG-CG 4.34Å; N1330-L1384 PolarHBondContact ND2-O 3.28Å; N1330-L1384 PolarHBondContact OD1-N 2.81Å
1385	P	88.8	Confident	84.4	Confident	0 Å²	0	35.3 Å²	35.3	0%	0	18%	0.18	C	C	.	.	P	Polyproline II helix	trans	-66.6	133.3	175.3	27.5	-33.4	0	0	0	110.5	F1013 E1018 F1326 L1390	F1013-P1385 HydrophobicContact CB-CB 4.18Å; F1013-P1385 HydrophobicContact CB-CG 4.16Å; F1013-P1385 HydrophobicContact CD1-CB 4.28Å; F1013-P1385 HydrophobicContact CD1-CG 4.39Å; F1013-P1385 HydrophobicContact CD2-CB 3.48Å; F1013-P1385 VanDerWaalsContact CD2-CB 3.48Å; F1013-P1385 HydrophobicContact CD2-CG 4.31Å; F1013-P1385 HydrophobicContact CE2-CB 3.87Å; F1013-P1385 HydrophobicContact CG-CB 3.72Å; F1013-P1385 HydrophobicContact CG-CG 4.04Å; F1013-P1385 HydrophobicContact CZ-CB 4.41Å; E1018-P1385 VanDerWaalsContact O-CD 3.29Å; E1018-P1385 WeakPolarHBondContact O-CD 3.47Å; F1326-P1385 WeakPolarHBondContact CD2-O 3.09Å; P1385-L1390 HydrophobicContact CG-CD1 4.46Å
1386	P	87.8	Confident	84.3	Confident	26 Å²	26	28.8 Å²	28.8	17%	0.169	15%	0.154	C	C	.	.	P	Polyproline II helix	trans	-50.3	149.7	168.2	-26.9	33.1	0	0	0	111.9	E1288 T1388 R1389 L1390	E1288-P1386 WeakPolarHBondContact OE2-CB 3.31Å; P1386-T1388 PolarHBondContact O-N 3.02Å; P1386-R1389 PolarHBondContact O-N 3.46Å; P1386-L1390 PolarHBondContact O-N 3.31Å
1387	M	86.8	Confident	84.1	Confident	19 Å²	19	31.4 Å²	31.4	9%	0.094	17%	0.166	C	C	.	.	G	3₁₀ helix	trans	-61.8	-34.3	-175.7	178	170.5	-89.4	0	0	111.3	E1288 L1292 K1319 R1322 L1323 R1389 L1390	E1288-M1387 PolarHBondContact OE2-N 3.36Å; L1292-M1387 HydrophobicContact CD1-CB 4.14Å; L1292-M1387 HydrophobicContact CD1-CG 3.74Å; L1292-M1387 HydrophobicContact CD1-SD 3.61Å; L1292-M1387 HydrophobicContact CD2-CG 4.24Å; K1319-M1387 WeakPolarHBondContact O-CE 3.22Å; R1322-M1387 HydrophobicContact CB-CE 3.76Å; R1322-M1387 HydrophobicContact CG-CE 3.83Å; L1323-M1387 HydrophobicContact CB-CE 4.34Å; L1323-M1387 HydrophobicContact CB-SD 4Å; L1323-M1387 HydrophobicContact CD1-CB 3.88Å; M1387-R1389 PolarHBondContact O-N 2.67Å; M1387-L1390 PolarHBondContact O-N 3.03Å; M1387-L1390 VanDerWaalsContact O-N 3.09Å
1388	T	87.2	Confident	84.1	Confident	51 Å²	51	27.3 Å²	27.3	31%	0.313	14%	0.144	S	C	.	.	G	3₁₀ helix	trans	-61.9	-20.3	174.3	56.8	0	0	0	0	114.6	E1288 I1291 L1292 P1386	E1288-T1388 HydrophobicContact CB-CG2 4.44Å; E1288-T1388 HydrophobicContact CG-CG2 4.47Å; E1288-T1388 WeakPolarHBondContact OE1-CB 3.3Å; E1288-T1388 WeakPolarHBondContact OE1-CG2 3.38Å; E1288-T1388 PolarHBondContact OE1-OG1 2.96Å; E1288-T1388 WeakPolarHBondContact OE2-CG2 3.36Å; E1288-T1388 PolarHBondContact OE2-N 3.33Å; E1288-T1388 PolarHBondContact OE2-OG1 2.95Å; I1291-T1388 HydrophobicContact CB-CG2 3.75Å; I1291-T1388 HydrophobicContact CD1-CG2 4.23Å; I1291-T1388 HydrophobicContact CG2-CG2 3.46Å; I1291-T1388 VanDerWaalsContact CG2-CG2 3.46Å; L1292-T1388 HydrophobicContact CD2-CG2 4.24Å; L1292-T1388 HydrophobicContact CG-CG2 4.02Å; P1386-T1388 PolarHBondContact O-N 3.02Å
1389	R	87.7	Confident	84	Confident	22 Å²	22	28.5 Å²	28.5	8%	0.083	15%	0.146	C	C	.	.	G	3₁₀ helix	trans	-97.1	-7.3	176.6	-70.9	169	66.6	-172.8	8.5	113.1	G1008 L1009 K1011 S1012 F1013 E1065 P1386 M1387	G1008-R1389 PolarHBondContact O-NH2 3.4Å; L1009-R1389 PolarHBondContact O-NE 3.17Å; K1011-R1389 PolarHBondContact O-NE 2.89Å; S1012-R1389 CarbonylContact C-O 3.6Å; S1012-R1389 WeakPolarHBondContact CA-O 3.3Å; F1013-R1389 HydrophobicContact CD2-CB 4.2Å; F1013-R1389 PolarHBondContact N-O 3.28Å; E1065-R1389 IonicContact OE1-CZ 3.27Å; E1065-R1389 IonicContact OE1-NH1 3.28Å; E1065-R1389 PolarHBondContact OE1-NH1 3.45Å; E1065-R1389 IonicContact OE1-NH2 2.8Å; E1065-R1389 IonicContact OE2-NH1 2.83Å; E1065-R1389 PolarHBondContact OE2-NH1 2.86Å; P1386-R1389 PolarHBondContact O-N 3.46Å; M1387-R1389 PolarHBondContact O-N 2.67Å
1390	L	80.8	Confident	83.7	Confident	13 Å²	13	28.7 Å²	28.7	7%	0.068	15%	0.147	C	C	.	.	B	Isolated β-bridge	trans	-94.3	114.6	-178.7	-173	69.5	0	0	0	110.9	F1013 P1016 P1385 P1386 M1387 V1392 Y1414	F1013-L1390 HydrophobicContact CB-CD1 4.27Å; P1016-L1390 HydrophobicContact CB-CD1 4.41Å; P1016-L1390 HydrophobicContact CB-CD2 4.49Å; P1385-L1390 HydrophobicContact CG-CD1 4.46Å; P1386-L1390 PolarHBondContact O-N 3.31Å; M1387-L1390 PolarHBondContact O-N 3.03Å; M1387-L1390 VanDerWaalsContact O-N 3.09Å; L1390-V1392 VanDerWaalsContact C-N 3.31Å; L1390-V1392 HydrophobicContact CD2-CG2 4.03Å; L1390-V1392 HydrophobicContact CG-CG2 4.18Å; L1390-V1392 PolarHBondContact O-N 2.96Å; L1390-Y1414 HydrophobicContact CD1-CD1 4.39Å; L1390-Y1414 HydrophobicContact CD1-CE1 4.08Å; L1390-Y1414 HydrophobicContact CD2-CE1 3.98Å; L1390-Y1414 HydrophobicContact CG-CE1 3.99Å
1391	K	69.2	Low	83.4	Confident	61 Å²	61	30.3 Å²	30.3	27%	0.265	15%	0.153	S	C	.	.			trans	-79.2	76.6	178	-79.5	168.4	169.9	162.5	0	111.7	S842 S1012 F1013 D1014 F1393	S842-K1391 WeakPolarHBondContact OG-CE 3.49Å; S842-K1391 PolarHBondContact OG-NZ 3.26Å; S1012-K1391 WeakPolarHBondContact OG-CE 3.46Å; S1012-K1391 PolarHBondContact OG-NZ 2.85Å; F1013-K1391 PolarHBondContact O-N 3.28Å; D1014-K1391 WeakPolarHBondContact OD1-CD 3.14Å; K1391-F1393 HydrophobicContact CB-CE2 4.09Å; K1391-F1393 PolarHBondContact O-N 2.83Å
1392	V	65.4	Low	82.6	Confident	40 Å²	40	33.9 Å²	33.9	24%	0.242	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	111.8	159.7	-172.5	0	0	0	0	107.1	L1390 Y1414	L1390-V1392 VanDerWaalsContact C-N 3.31Å; L1390-V1392 HydrophobicContact CD2-CG2 4.03Å; L1390-V1392 HydrophobicContact CG-CG2 4.18Å; L1390-V1392 PolarHBondContact O-N 2.96Å; V1392-Y1414 HydrophobicContact CB-CE1 4.47Å; V1392-Y1414 HydrophobicContact CG2-CD1 4.25Å; V1392-Y1414 HydrophobicContact CG2-CE1 3.58Å
1393	F	62.4	Low	81.3	Confident	70 Å²	70	36.1 Å²	36.1	31%	0.307	19%	0.191	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	-61.3	177.5	-76.2	-89.2	0	0	0	110.1	K1391 I1413 L1480	K1391-F1393 HydrophobicContact CB-CE2 4.09Å; K1391-F1393 PolarHBondContact O-N 2.83Å; F1393-I1413 PolarHBondContact N-O 3.01Å; F1393-L1480 HydrophobicContact CD1-CD2 4.22Å; F1393-L1480 HydrophobicContact CD2-CD1 3.88Å; F1393-L1480 HydrophobicContact CD2-CD2 3.97Å; F1393-L1480 HydrophobicContact CE1-CD2 3.8Å; F1393-L1480 HydrophobicContact CE2-CD1 4.23Å; F1393-L1480 HydrophobicContact CE2-CD2 3.53Å; F1393-L1480 HydrophobicContact CG-CD1 4.15Å; F1393-L1480 HydrophobicContact CG-CD2 4.3Å; F1393-L1480 HydrophobicContact CZ-CD2 3.43Å; F1393-L1480 VanDerWaalsContact CZ-CD2 3.43Å
1394	Q	75.8	Confident	79.8	Confident	52 Å²	52	43.5 Å²	43.5	24%	0.243	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.5	152.1	-174.6	-67.7	173.7	-45	0	0	110.6	Y1396 I1413 T1476	Q1394-Y1396 HydrophobicContact CB-CD2 4.08Å; Q1394-Y1396 HydrophobicContact CB-CE2 3.4Å; Q1394-Y1396 VanDerWaalsContact CB-CE2 3.4Å; Q1394-Y1396 HydrophobicContact CG-CE2 4.27Å; Q1394-Y1396 PolarHBondContact NE2-OH 3.32Å; Q1394-Y1396 PolarHBondContact OE1-OH 2.95Å; Q1394-I1413 PolarHBondContact O-N 2.88Å; Q1394-T1476 PolarHBondContact OE1-OG1 2.72Å
1395	S	84.5	Confident	78.4	Confident	23 Å²	23	44.7 Å²	44.7	16%	0.161	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	132.4	174.6	-49.2	0	0	0	0	108.5	L1411	S1395-L1411 CarbonylContact C-O 3.5Å; S1395-L1411 VanDerWaalsContact CA-O 3.31Å; S1395-L1411 WeakPolarHBondContact CA-O 3.21Å
1396	Y	84.5	Confident	77.4	Confident	19 Å²	19	50.7 Å²	50.7	8%	0.075	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	141.7	-173.6	-70.6	-82.5	0	0	0	111.9	Q1394 I1410 L1411 I1413 K1469 Q1472 I1473	Q1394-Y1396 HydrophobicContact CB-CD2 4.08Å; Q1394-Y1396 HydrophobicContact CB-CE2 3.4Å; Q1394-Y1396 VanDerWaalsContact CB-CE2 3.4Å; Q1394-Y1396 HydrophobicContact CG-CE2 4.27Å; Q1394-Y1396 PolarHBondContact NE2-OH 3.32Å; Q1394-Y1396 PolarHBondContact OE1-OH 2.95Å; Y1396-I1410 CarbonylContact O-C 3.6Å; Y1396-I1410 WeakPolarHBondContact O-CA 3.35Å; Y1396-L1411 PolarHBondContact N-O 2.93Å; Y1396-L1411 PolarHBondContact O-N 2.92Å; Y1396-I1413 HydrophobicContact CD2-CD1 3.99Å; Y1396-I1413 HydrophobicContact CE2-CD1 3.83Å; Y1396-K1469 HydrophobicContact CD1-CB 4.16Å; Y1396-K1469 HydrophobicContact CD1-CD 4.17Å; Y1396-K1469 HydrophobicContact CE1-CB 3.84Å; Y1396-K1469 HydrophobicContact CE1-CD 3.69Å; Y1396-K1469 HydrophobicContact CE1-CG 4.38Å; Y1396-Q1472 VanDerWaalsContact OH-CD 3.31Å; Y1396-Q1472 PolarHBondContact OH-OE1 3.14Å; Y1396-Q1472 VanDerWaalsContact OH-OE1 3.06Å; Y1396-I1473 HydrophobicContact CD1-CD1 4.01Å; Y1396-I1473 HydrophobicContact CD1-CG1 4.12Å; Y1396-I1473 HydrophobicContact CD2-CD1 3.89Å; Y1396-I1473 HydrophobicContact CD2-CG1 3.59Å; Y1396-I1473 HydrophobicContact CE1-CD1 4.45Å; Y1396-I1473 HydrophobicContact CE1-CG1 4.11Å; Y1396-I1473 HydrophobicContact CE2-CD1 4.34Å; Y1396-I1473 HydrophobicContact CE2-CG1 3.56Å; Y1396-I1473 HydrophobicContact CG-CD1 3.69Å; Y1396-I1473 HydrophobicContact CG-CG1 3.86Å
1397	E	85.9	Confident	76.8	Confident	70 Å²	70	55.2 Å²	55.2	33%	0.327	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	130.3	165.7	169.8	161.9	-147	0	0	109.7	N1309 T1311 C1467	N1309-E1397 PolarHBondContact ND2-OE2 3.01Å; T1311-E1397 WeakPolarHBondContact CB-OE1 3.23Å; T1311-E1397 HydrophobicContact CG2-CB 3.79Å; T1311-E1397 HydrophobicContact CG2-CG 3.72Å; T1311-E1397 PolarHBondContact OG1-OE1 3.48Å; E1397-C1467 PolarHBondContact O-SG 2.95Å
1398	I	87.1	Confident	76.5	Confident	4 Å²	4	56 Å²	56	2%	0.021	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146	152.7	-175	59.8	142.4	0	0	0	112.6	I1400 T1409 L1411 V1420 I1465 R1466 C1467	I1398-I1400 HydrophobicContact CD1-CG1 4.48Å; I1398-T1409 WeakPolarHBondContact CD1-OG1 3.49Å; I1398-T1409 WeakPolarHBondContact CG1-O 3.45Å; I1398-T1409 WeakPolarHBondContact CG1-OG1 3.49Å; I1398-T1409 PolarHBondContact N-O 2.55Å; I1398-T1409 CarbonylContact O-C 3.51Å; I1398-T1409 WeakPolarHBondContact O-CA 3.37Å; I1398-T1409 PolarHBondContact O-N 3Å; I1398-T1409 VanDerWaalsContact O-O 3.09Å; I1398-T1409 PolarHBondContact O-OG1 3.06Å; I1398-L1411 HydrophobicContact CD1-CB 3.79Å; I1398-L1411 HydrophobicContact CG1-CB 3.87Å; I1398-L1411 HydrophobicContact CG2-CB 3.8Å; I1398-L1411 HydrophobicContact CG2-CD2 4.4Å; I1398-V1420 HydrophobicContact CD1-CG1 3.96Å; I1398-V1420 HydrophobicContact CD1-CG2 4.25Å; I1398-I1465 HydrophobicContact CB-CG2 3.46Å; I1398-I1465 VanDerWaalsContact CB-CG2 3.46Å; I1398-I1465 HydrophobicContact CD1-CD1 4.19Å; I1398-I1465 HydrophobicContact CD1-CG2 3.68Å; I1398-I1465 HydrophobicContact CG1-CG2 4.19Å; I1398-I1465 HydrophobicContact CG2-CG2 3.65Å; I1398-R1466 WeakPolarHBondContact CA-O 3.15Å; I1398-C1467 HydrophobicContact CG2-CB 3.98Å
1399	E	85.6	Confident	76.5	Confident	38 Å²	38	53.8 Å²	53.8	18%	0.178	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	125.5	174.8	-179.5	-166.5	166.4	0	0	109.5	L1401 N1406 I1465 R1466	E1399-L1401 PolarHBondContact O-N 3.23Å; E1399-N1406 PolarHBondContact OE1-ND2 3.07Å; E1399-I1465 CarbonylContact O-C 3.55Å; E1399-I1465 WeakPolarHBondContact O-CA 3.44Å; E1399-R1466 HydrophobicContact CB-CB 4.27Å; E1399-R1466 PolarHBondContact N-O 3.49Å; E1399-R1466 PolarHBondContact O-N 2.84Å; E1399-R1466 IonicContact OE1-CZ 3.99Å; E1399-R1466 IonicContact OE1-NH1 2.86Å; E1399-R1466 PolarHBondContact OE1-NH1 3.32Å; E1399-R1466 WeakPolarHBondContact OE2-CD 3.44Å; E1399-R1466 IonicContact OE2-CZ 3.61Å; E1399-R1466 IonicContact OE2-NE 3.91Å; E1399-R1466 IonicContact OE2-NH1 2.65Å; E1399-R1466 PolarHBondContact OE2-NH1 2.89Å
1400	I	84.6	Confident	76.5	Confident	11 Å²	11	52.9 Å²	52.9	6%	0.056	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	111.7	-177.6	-57.7	171.8	0	0	0	109.7	I1398 S1402 N1403 T1409 V1420 I1428 L1463	I1398-I1400 HydrophobicContact CD1-CG1 4.48Å; I1400-S1402 VanDerWaalsContact CG2-OG 3.25Å; I1400-S1402 WeakPolarHBondContact CG2-OG 3.31Å; I1400-S1402 PolarHBondContact O-N 2.91Å; I1400-S1402 VanDerWaalsContact O-N 3.1Å; I1400-N1403 PolarHBondContact O-N 3.16Å; I1400-T1409 HydrophobicContact CD1-CG2 4.01Å; I1400-T1409 HydrophobicContact CG1-CG2 4.41Å; I1400-V1420 HydrophobicContact CD1-CG1 3.69Å; I1400-V1420 HydrophobicContact CG1-CG1 4.37Å; I1400-I1428 HydrophobicContact CD1-CD1 4.33Å; I1400-L1463 HydrophobicContact CG2-CD1 3.76Å
1401	L	82	Confident	76.9	Confident	60 Å²	60	52.3 Å²	52.3	31%	0.314	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.5	-4	-174.1	-69.4	161.1	0	0	0	114.7	E1399 I1445 R1464 R1466	E1399-L1401 PolarHBondContact O-N 3.23Å; L1401-I1445 HydrophobicContact CD1-CB 4.4Å; L1401-I1445 HydrophobicContact CD1-CD1 3.96Å; L1401-I1445 HydrophobicContact CD1-CG1 4.01Å; L1401-I1445 HydrophobicContact CD1-CG2 3.58Å; L1401-R1464 HydrophobicContact CB-CB 3.94Å; L1401-R1464 HydrophobicContact CD1-CB 3.93Å; L1401-R1464 PolarHBondContact N-O 2.94Å; L1401-R1466 HydrophobicContact CD1-CB 4.29Å; L1401-R1466 HydrophobicContact CD2-CB 4.49Å; L1401-R1466 HydrophobicContact CG-CB 4.39Å
1402	S	74.2	Confident	77.9	Confident	81 Å²	81	49.8 Å²	49.8	57%	0.566	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.2	-8.3	176.3	60.4	0	0	0	0	114.3	I1400	I1400-S1402 VanDerWaalsContact CG2-OG 3.25Å; I1400-S1402 WeakPolarHBondContact CG2-OG 3.31Å; I1400-S1402 PolarHBondContact O-N 2.91Å; I1400-S1402 VanDerWaalsContact O-N 3.1Å
1403	N	63.9	Low	78.9	Confident	75 Å²	75	47.9 Å²	47.9	40%	0.401	26%	0.264	S	S	.	.	S	Bend	trans	-88.9	149.8	175.7	-85.9	3.9	0	0	0	111.4	I1400 S1405	I1400-N1403 PolarHBondContact O-N 3.16Å; N1403-S1405 VanDerWaalsContact C-N 3.35Å; N1403-S1405 WeakPolarHBondContact CB-O 3.22Å
1404	V	61.3	Low	80	Confident	155 Å²	155	44.5 Å²	44.5	94%	0.939	25%	0.249	S	C	*	.	S	Bend	trans	-78.8	-23.8	176.5	-174.6	0	0	0	0	111.2
1405	S	61.9	Low	80.2	Confident	48 Å²	48	42.5 Å²	42.5	34%	0.336	24%	0.242	S	C	.	.	S	Bend	trans	-92.4	126.7	166.1	54	0	0	0	0	110.6	N1403 E1407	N1403-S1405 VanDerWaalsContact C-N 3.35Å; N1403-S1405 WeakPolarHBondContact CB-O 3.22Å; S1405-E1407 WeakPolarHBondContact CB-OE1 3.27Å; S1405-E1407 PolarHBondContact O-N 2.91Å; S1405-E1407 VanDerWaalsContact OG-CD 3.3Å; S1405-E1407 PolarHBondContact OG-OE1 3.01Å
1406	N	66.4	Low	80	Confident	126 Å²	126	46.4 Å²	46.4	67%	0.674	26%	0.256	S	S	*	.			trans	-77.3	50.1	172.3	-66.9	5.3	0	0	0	110.6	E1399	E1399-N1406 PolarHBondContact OE1-ND2 3.07Å
1407	E	75.5	Confident	80.1	Confident	122 Å²	122	45.5 Å²	45.5	57%	0.57	25%	0.253	S	S	*	.			trans	-76	136.7	179.8	-80	161.2	-135.4	0	0	111.1	S1405	S1405-E1407 WeakPolarHBondContact CB-OE1 3.27Å; S1405-E1407 PolarHBondContact O-N 2.91Å; S1405-E1407 VanDerWaalsContact OG-CD 3.3Å; S1405-E1407 PolarHBondContact OG-OE1 3.01Å
1408	A	80.1	Confident	80.3	Confident	34 Å²	34	42.2 Å²	42.2	28%	0.281	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.2	133.7	174.3	0	0	0	0	0	110.2	L1423	A1408-L1423 HydrophobicContact CB-CD2 4.49Å; A1408-L1423 WeakPolarHBondContact O-CG 3.47Å
1409	T	87	Confident	80.3	Confident	5 Å²	5	42 Å²	42	3%	0.031	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	166.2	180	54	0	0	0	0	109.8	I1398 I1400 R1421 I1428	I1398-T1409 WeakPolarHBondContact CD1-OG1 3.49Å; I1398-T1409 WeakPolarHBondContact CG1-O 3.45Å; I1398-T1409 WeakPolarHBondContact CG1-OG1 3.49Å; I1398-T1409 PolarHBondContact N-O 2.55Å; I1398-T1409 CarbonylContact O-C 3.51Å; I1398-T1409 WeakPolarHBondContact O-CA 3.37Å; I1398-T1409 PolarHBondContact O-N 3Å; I1398-T1409 VanDerWaalsContact O-O 3.09Å; I1398-T1409 PolarHBondContact O-OG1 3.06Å; I1400-T1409 HydrophobicContact CD1-CG2 4.01Å; I1400-T1409 HydrophobicContact CG1-CG2 4.41Å; T1409-R1421 CarbonylContact C-O 3.58Å; T1409-R1421 WeakPolarHBondContact CA-O 3.32Å; T1409-R1421 VanDerWaalsContact CB-O 3.29Å; T1409-R1421 WeakPolarHBondContact CB-O 3.25Å; T1409-I1428 HydrophobicContact CG2-CD1 3.58Å
1410	I	88.5	Confident	80.5	Confident	3 Å²	3	40.3 Å²	40.3	2%	0.015	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	121.8	-175.7	-60.7	165.9	0	0	0	108.9	T1311 I1315 L1318 Y1396 E1412 V1420 R1421 L1423	T1311-I1410 HydrophobicContact CG2-CG1 4.21Å; I1315-I1410 HydrophobicContact CD1-CG1 4.36Å; I1315-I1410 HydrophobicContact CD1-CG2 4.32Å; I1315-I1410 HydrophobicContact CG1-CD1 3.65Å; I1315-I1410 HydrophobicContact CG1-CG1 3.82Å; I1315-I1410 HydrophobicContact CG1-CG2 3.88Å; L1318-I1410 HydrophobicContact CD1-CD1 3.57Å; Y1396-I1410 CarbonylContact O-C 3.6Å; Y1396-I1410 WeakPolarHBondContact O-CA 3.35Å; I1410-E1412 HydrophobicContact CG2-CG 4.25Å; I1410-V1420 CarbonylContact O-C 3.59Å; I1410-V1420 WeakPolarHBondContact O-CA 3.28Å; I1410-R1421 PolarHBondContact N-O 3.38Å; I1410-R1421 PolarHBondContact O-N 3.34Å; I1410-L1423 HydrophobicContact CD1-CD2 4.33Å; I1410-L1423 HydrophobicContact CG1-CD2 4.5Å
1411	L	90	Very high	80.7	Confident	2 Å²	2	40.1 Å²	40.1	1%	0.01	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	119.8	171.2	179.5	67	0	0	0	108.9	S1395 Y1396 I1398 I1413 L1418 V1420 I1473	S1395-L1411 CarbonylContact C-O 3.5Å; S1395-L1411 VanDerWaalsContact CA-O 3.31Å; S1395-L1411 WeakPolarHBondContact CA-O 3.21Å; Y1396-L1411 PolarHBondContact N-O 2.93Å; Y1396-L1411 PolarHBondContact O-N 2.92Å; I1398-L1411 HydrophobicContact CD1-CB 3.79Å; I1398-L1411 HydrophobicContact CG1-CB 3.87Å; I1398-L1411 HydrophobicContact CG2-CB 3.8Å; I1398-L1411 HydrophobicContact CG2-CD2 4.4Å; L1411-I1413 HydrophobicContact CG-CG1 4.4Å; L1411-L1418 HydrophobicContact CD1-CB 4.24Å; L1411-L1418 HydrophobicContact CD1-CD2 4.45Å; L1411-V1420 HydrophobicContact CD1-CG2 3.8Å; L1411-I1473 HydrophobicContact CD2-CD1 4.43Å; L1411-I1473 HydrophobicContact CD2-CG2 3.95Å
1412	E	88.5	Confident	81	Confident	7 Å²	7	38.9 Å²	38.9	3%	0.033	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	128.8	170.5	-63.1	-174.9	114.3	0	0	110	R1322 I1410 Y1414 T1419 R1421	R1322-E1412 IonicContact CZ-OE1 2.75Å; R1322-E1412 VanDerWaalsContact CZ-OE1 3.27Å; R1322-E1412 IonicContact CZ-OE2 3.23Å; R1322-E1412 IonicContact NH1-OE1 3.4Å; R1322-E1412 PolarHBondContact NH1-OE1 2.82Å; R1322-E1412 IonicContact NH1-OE2 2.75Å; R1322-E1412 IonicContact NH2-OE1 3.78Å; R1322-E1412 PolarHBondContact NH2-OE1 3.24Å; R1322-E1412 IonicContact NH2-OE2 3.38Å; R1322-E1412 PolarHBondContact NH2-OE2 2.88Å; I1410-E1412 HydrophobicContact CG2-CG 4.25Å; E1412-Y1414 HydrophobicContact CB-CD2 4.27Å; E1412-Y1414 HydrophobicContact CB-CE2 3.59Å; E1412-Y1414 PolarHBondContact OE2-OH 2.89Å; E1412-T1419 PolarHBondContact N-O 3Å; E1412-T1419 PolarHBondContact O-N 2.83Å; E1412-R1421 WeakPolarHBondContact OE2-CD 3.45Å; E1412-R1421 IonicContact OE2-CZ 3.99Å; E1412-R1421 IonicContact OE2-NE 3.84Å; E1412-R1421 PolarHBondContact OE2-NE 2.66Å; E1412-R1421 IonicContact OE2-NH2 3.08Å
1413	I	87.2	Confident	81.5	Confident	0 Å²	0	38 Å²	38	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	118.3	-179.3	-51.3	179.4	0	0	0	109	F1393 Q1394 Y1396 L1411 L1418 Y1433 I1473 T1476 I1477 L1480	F1393-I1413 PolarHBondContact N-O 3.01Å; Q1394-I1413 PolarHBondContact O-N 2.88Å; Y1396-I1413 HydrophobicContact CD2-CD1 3.99Å; Y1396-I1413 HydrophobicContact CE2-CD1 3.83Å; L1411-I1413 HydrophobicContact CG-CG1 4.4Å; I1413-L1418 HydrophobicContact CB-CD2 4.21Å; I1413-L1418 HydrophobicContact CG1-CD2 3.96Å; I1413-L1418 HydrophobicContact CG2-CD2 3.95Å; I1413-Y1433 WeakPolarHBondContact CG2-OH 3.19Å; I1413-I1473 HydrophobicContact CD1-CG1 4.46Å; I1413-I1473 HydrophobicContact CD1-CG2 3.98Å; I1413-T1476 HydrophobicContact CD1-CG2 4.31Å; I1413-T1476 HydrophobicContact CG2-CG2 4.21Å; I1413-I1477 HydrophobicContact CD1-CG1 4.42Å; I1413-I1477 HydrophobicContact CG2-CG1 4.41Å; I1413-L1480 HydrophobicContact CG2-CD1 3.6Å
1414	Y	85.7	Confident	82.5	Confident	0 Å²	0	37 Å²	37	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	172.8	174.7	-62.4	-100.5	0	0	0	111	D1014 P1016 R1322 L1390 V1392 E1412 K1416 C1417 T1419 Y1433	D1014-Y1414 VanDerWaalsContact O-CB 3.28Å; D1014-Y1414 WeakPolarHBondContact O-CB 3.12Å; P1016-Y1414 HydrophobicContact CB-CE1 3.88Å; P1016-Y1414 HydrophobicContact CG-CD1 4.49Å; P1016-Y1414 HydrophobicContact CG-CE1 3.93Å; P1016-Y1414 HydrophobicContact CG-CE2 3.99Å; R1322-Y1414 PolarHBondContact NH1-OH 2.78Å; L1390-Y1414 HydrophobicContact CD1-CD1 4.39Å; L1390-Y1414 HydrophobicContact CD1-CE1 4.08Å; L1390-Y1414 HydrophobicContact CD2-CE1 3.98Å; L1390-Y1414 HydrophobicContact CG-CE1 3.99Å; V1392-Y1414 HydrophobicContact CB-CE1 4.47Å; V1392-Y1414 HydrophobicContact CG2-CD1 4.25Å; V1392-Y1414 HydrophobicContact CG2-CE1 3.58Å; E1412-Y1414 HydrophobicContact CB-CD2 4.27Å; E1412-Y1414 HydrophobicContact CB-CE2 3.59Å; E1412-Y1414 PolarHBondContact OE2-OH 2.89Å; Y1414-K1416 VanDerWaalsContact C-N 3.3Å; Y1414-K1416 PolarHBondContact O-N 3.08Å; Y1414-C1417 WeakPolarHBondContact CA-O 3.37Å; Y1414-C1417 WeakPolarHBondContact CB-O 3.27Å; Y1414-C1417 PolarHBondContact N-O 3.45Å; Y1414-T1419 WeakPolarHBondContact CE2-OG1 3.08Å; Y1414-Y1433 WeakPolarHBondContact O-CE2 3.46Å; Y1414-Y1433 PolarHBondContact O-OH 2.82Å
1415	G	80.3	Confident	83.5	Confident	9 Å²	9	29.7 Å²	29.7	9%	0.093	16%	0.164	C	C	.	.	S	Bend	trans	-68.1	-21.5	-179.4	0	0	0	0	0	115.2	Y1433	G1415-Y1433 WeakPolarHBondContact O-CE2 2.99Å
1416	K	80.5	Confident	84.6	Confident	106 Å²	106	32.1 Å²	32.1	46%	0.461	17%	0.17	S	C	.	.	S	Bend	trans	-126.5	-11.4	179.4	-70.5	177.8	-170.4	-179	0	115.1	D1014 Y1414 Y1433	D1014-K1416 HydrophobicContact CB-CB 4.08Å; D1014-K1416 HydrophobicContact CB-CD 3.88Å; D1014-K1416 HydrophobicContact CB-CG 3.66Å; D1014-K1416 PolarHBondContact O-N 3.08Å; D1014-K1416 VanDerWaalsContact O-N 3.1Å; Y1414-K1416 VanDerWaalsContact C-N 3.3Å; Y1414-K1416 PolarHBondContact O-N 3.08Å; K1416-Y1433 WeakPolarHBondContact O-CD2 3.49Å; K1416-Y1433 PolarHBondContact O-N 3.16Å
1417	C	86.6	Confident	85.5	Confident	0 Å²	0	28.7 Å²	28.7	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.5	164.1	-177.1	64.4	0	0	0	0	113.2	Y1414 L1431 N1432	Y1414-C1417 WeakPolarHBondContact CA-O 3.37Å; Y1414-C1417 WeakPolarHBondContact CB-O 3.27Å; Y1414-C1417 PolarHBondContact N-O 3.45Å; C1417-L1431 CarbonylContact C-O 3.51Å; C1417-L1431 WeakPolarHBondContact CA-O 3.29Å; C1417-L1431 VanDerWaalsContact CB-O 3.26Å; C1417-L1431 WeakPolarHBondContact CB-O 3.39Å; C1417-N1432 WeakPolarHBondContact CB-OD1 3.44Å
1418	L	88.9	Confident	86	Confident	1 Å²	1	26.7 Å²	26.7	1%	0.005	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	132.8	168.5	-59.9	167.6	0	0	0	107.7	L1411 I1413 K1430 L1431 Y1433 L1448 I1477	L1411-L1418 HydrophobicContact CD1-CB 4.24Å; L1411-L1418 HydrophobicContact CD1-CD2 4.45Å; I1413-L1418 HydrophobicContact CB-CD2 4.21Å; I1413-L1418 HydrophobicContact CG1-CD2 3.96Å; I1413-L1418 HydrophobicContact CG2-CD2 3.95Å; L1418-K1430 WeakPolarHBondContact O-CA 3.29Å; L1418-L1431 HydrophobicContact CB-CB 4.35Å; L1418-L1431 PolarHBondContact N-O 3.26Å; L1418-L1431 PolarHBondContact O-N 3.39Å; L1418-Y1433 HydrophobicContact CD1-CE1 4.1Å; L1418-Y1433 HydrophobicContact CD2-CE1 4.06Å; L1418-Y1433 HydrophobicContact CG-CE1 3.74Å; L1418-L1448 HydrophobicContact CD1-CD1 4.4Å; L1418-L1448 HydrophobicContact CD1-CD2 4.11Å; L1418-I1477 HydrophobicContact CD1-CD1 3.96Å; L1418-I1477 HydrophobicContact CD2-CD1 3.89Å; L1418-I1477 HydrophobicContact CD2-CG1 4.01Å
1419	T	88.8	Confident	86.3	Confident	0 Å²	0	28.1 Å²	28.1	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	134.2	168.5	55.8	0	0	0	0	111.2	E1412 Y1414 I1427 K1429 K1430	E1412-T1419 PolarHBondContact N-O 3Å; E1412-T1419 PolarHBondContact O-N 2.83Å; Y1414-T1419 WeakPolarHBondContact CE2-OG1 3.08Å; T1419-I1427 HydrophobicContact CG2-CG2 4.49Å; T1419-K1429 WeakPolarHBondContact CA-O 3.43Å; T1419-K1430 HydrophobicContact CG2-CB 3.95Å; T1419-K1430 HydrophobicContact CG2-CD 4.02Å; T1419-K1430 HydrophobicContact CG2-CG 3.79Å
1420	V	89.2	Confident	86.3	Confident	2 Å²	2	30.6 Å²	30.6	1%	0.012	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	123.8	174.7	178.6	0	0	0	0	108	I1398 I1400 I1410 L1411 I1428 K1429 L1463	I1398-V1420 HydrophobicContact CD1-CG1 3.96Å; I1398-V1420 HydrophobicContact CD1-CG2 4.25Å; I1400-V1420 HydrophobicContact CD1-CG1 3.69Å; I1400-V1420 HydrophobicContact CG1-CG1 4.37Å; I1410-V1420 CarbonylContact O-C 3.59Å; I1410-V1420 WeakPolarHBondContact O-CA 3.28Å; L1411-V1420 HydrophobicContact CD1-CG2 3.8Å; V1420-I1428 HydrophobicContact CG1-CB 4.5Å; V1420-I1428 HydrophobicContact CG1-CD1 4.36Å; V1420-I1428 PolarHBondContact O-N 3.14Å; V1420-K1429 HydrophobicContact CB-CB 4.5Å; V1420-K1429 PolarHBondContact N-O 3.39Å; V1420-K1429 PolarHBondContact O-N 2.67Å; V1420-L1463 HydrophobicContact CG2-CD2 4.46Å
1421	R	88.4	Confident	86.2	Confident	7 Å²	7	30.7 Å²	30.7	3%	0.026	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	151.3	-179.1	-63.9	-176.5	-174.4	-84.9	-10.8	112.4	T1409 I1410 E1412 G1425 E1426 I1427	T1409-R1421 CarbonylContact C-O 3.58Å; T1409-R1421 WeakPolarHBondContact CA-O 3.32Å; T1409-R1421 VanDerWaalsContact CB-O 3.29Å; T1409-R1421 WeakPolarHBondContact CB-O 3.25Å; I1410-R1421 PolarHBondContact N-O 3.38Å; I1410-R1421 PolarHBondContact O-N 3.34Å; E1412-R1421 WeakPolarHBondContact OE2-CD 3.45Å; E1412-R1421 IonicContact OE2-CZ 3.99Å; E1412-R1421 IonicContact OE2-NE 3.84Å; E1412-R1421 PolarHBondContact OE2-NE 2.66Å; E1412-R1421 IonicContact OE2-NH2 3.08Å; R1421-G1425 WeakPolarHBondContact CD-O 3.34Å; R1421-G1425 PolarHBondContact NH1-O 3.33Å; R1421-E1426 CarbonylContact C-O 3.54Å; R1421-E1426 WeakPolarHBondContact CA-O 3.31Å; R1421-E1426 WeakPolarHBondContact CB-O 3.41Å; R1421-I1427 HydrophobicContact CG-CG1 4.45Å
1422	N	88.1	Confident	86	Confident	33 Å²	33	33.1 Å²	33.1	18%	0.176	17%	0.167	C	C	.	.			trans	-75.4	171.7	162.3	67.5	9.9	0	0	0	110.4	S1424 G1425 E1426 I1428	N1422-S1424 PolarHBondContact O-N 3.19Å; N1422-S1424 WeakPolarHBondContact OD1-CB 3.38Å; N1422-S1424 PolarHBondContact OD1-N 3.48Å; N1422-G1425 PolarHBondContact O-N 2.93Å; N1422-G1425 VanDerWaalsContact O-N 3.17Å; N1422-G1425 PolarHBondContact OD1-N 3.28Å; N1422-E1426 PolarHBondContact N-O 3.45Å; N1422-E1426 VanDerWaalsContact N-O 3.09Å; N1422-E1426 PolarHBondContact ND2-OE2 3.29Å; N1422-E1426 WeakPolarHBondContact OD1-CB 3.45Å; N1422-E1426 PolarHBondContact OD1-N 3.15Å; N1422-I1428 HydrophobicContact CB-CD1 3.93Å; N1422-I1428 HydrophobicContact CB-CG1 4.17Å
1423	L	85.3	Confident	85.8	Confident	63 Å²	63	33.2 Å²	33.2	33%	0.33	17%	0.167	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-34.6	176.1	-62	179	0	0	0	111.9	T1311 R1314 A1408 I1410 G1425	T1311-L1423 HydrophobicContact CG2-CD2 3.95Å; R1314-L1423 HydrophobicContact CB-CD2 4.45Å; R1314-L1423 WeakPolarHBondContact CD-O 3.28Å; R1314-L1423 HydrophobicContact CG-CB 4.27Å; R1314-L1423 HydrophobicContact CG-CD2 4.46Å; R1314-L1423 WeakPolarHBondContact CG-O 3.08Å; R1314-L1423 PolarHBondContact NE-O 3.07Å; A1408-L1423 HydrophobicContact CB-CD2 4.49Å; A1408-L1423 WeakPolarHBondContact O-CG 3.47Å; I1410-L1423 HydrophobicContact CD1-CD2 4.33Å; I1410-L1423 HydrophobicContact CG1-CD2 4.5Å; L1423-G1425 PolarHBondContact O-N 2.8Å
1424	S	83.9	Confident	85.5	Confident	55 Å²	55	40.2 Å²	40.2	39%	0.385	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60	-27.8	176.9	-53.8	0	0	0	0	113.4	R1314 N1422	R1314-S1424 PolarHBondContact NH2-O 3.37Å; N1422-S1424 PolarHBondContact O-N 3.19Å; N1422-S1424 WeakPolarHBondContact OD1-CB 3.38Å; N1422-S1424 PolarHBondContact OD1-N 3.48Å
1425	G	81.9	Confident	85.3	Confident	0 Å²	0	41.9 Å²	41.9	0%	0	21%	0.212	C	C	.	.	S	Bend	trans	114.2	-4.8	177.5	0	0	0	0	0	114.4	Y1361 R1421 N1422 L1423	Y1361-G1425 WeakPolarHBondContact CD1-O 3.44Å; Y1361-G1425 WeakPolarHBondContact CE1-O 3.39Å; R1421-G1425 WeakPolarHBondContact CD-O 3.34Å; R1421-G1425 PolarHBondContact NH1-O 3.33Å; N1422-G1425 PolarHBondContact O-N 2.93Å; N1422-G1425 VanDerWaalsContact O-N 3.17Å; N1422-G1425 PolarHBondContact OD1-N 3.28Å; L1423-G1425 PolarHBondContact O-N 2.8Å
1426	E	85.5	Confident	85.4	Confident	100 Å²	100	42.4 Å²	42.4	47%	0.467	21%	0.213	S	C	.	.			trans	-68	143.9	179	-63.8	170.7	139.8	0	0	111.2	Y1361 R1421 N1422 I1428	Y1361-E1426 HydrophobicContact CD2-CB 4.14Å; Y1361-E1426 HydrophobicContact CD2-CG 3.43Å; Y1361-E1426 VanDerWaalsContact CD2-CG 3.43Å; Y1361-E1426 HydrophobicContact CE2-CB 4.27Å; Y1361-E1426 HydrophobicContact CE2-CG 3.97Å; Y1361-E1426 HydrophobicContact CG-CG 4.14Å; R1421-E1426 CarbonylContact C-O 3.54Å; R1421-E1426 WeakPolarHBondContact CA-O 3.31Å; R1421-E1426 WeakPolarHBondContact CB-O 3.41Å; N1422-E1426 PolarHBondContact N-O 3.45Å; N1422-E1426 VanDerWaalsContact N-O 3.09Å; N1422-E1426 PolarHBondContact ND2-OE2 3.29Å; N1422-E1426 WeakPolarHBondContact OD1-CB 3.45Å; N1422-E1426 PolarHBondContact OD1-N 3.15Å; E1426-I1428 PolarHBondContact O-N 3.26Å
1427	I	86.3	Confident	85.4	Confident	53 Å²	53	41.5 Å²	41.5	27%	0.272	21%	0.212	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	109.7	175.6	-56.2	176.6	0	0	0	108.5	T1419 R1421 K1430	T1419-I1427 HydrophobicContact CG2-CG2 4.49Å; R1421-I1427 HydrophobicContact CG-CG1 4.45Å; I1427-K1430 HydrophobicContact CG2-CB 4.27Å
1428	I	85.9	Confident	85.3	Confident	81 Å²	81	45 Å²	45	42%	0.415	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	-46.9	172.5	-57.5	168.7	0	0	0	109.5	I1400 T1409 V1420 N1422 E1426	I1400-I1428 HydrophobicContact CD1-CD1 4.33Å; T1409-I1428 HydrophobicContact CG2-CD1 3.58Å; V1420-I1428 HydrophobicContact CG1-CB 4.5Å; V1420-I1428 HydrophobicContact CG1-CD1 4.36Å; V1420-I1428 PolarHBondContact O-N 3.14Å; N1422-I1428 HydrophobicContact CB-CD1 3.93Å; N1422-I1428 HydrophobicContact CB-CG1 4.17Å; E1426-I1428 PolarHBondContact O-N 3.26Å
1429	K	86	Confident	85.1	Confident	63 Å²	63	46.3 Å²	46.3	27%	0.274	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.5	139.2	-178.9	-161.6	151.1	-168.8	148.2	0	111.3	T1419 V1420 L1431 F1450 E1452	T1419-K1429 WeakPolarHBondContact CA-O 3.43Å; V1420-K1429 HydrophobicContact CB-CB 4.5Å; V1420-K1429 PolarHBondContact N-O 3.39Å; V1420-K1429 PolarHBondContact O-N 2.67Å; K1429-L1431 HydrophobicContact CG-CD2 4.32Å; K1429-L1431 HydrophobicContact CG-CG 4.4Å; K1429-F1450 HydrophobicContact CD-CZ 4.46Å; K1429-F1450 VanDerWaalsContact CE-CZ 3.44Å; K1429-E1452 IonicContact NZ-OE1 2.67Å; K1429-E1452 PolarHBondContact NZ-OE1 3.34Å
1430	K	87.7	Confident	85	Confident	57 Å²	57	48.7 Å²	48.7	25%	0.248	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	135.6	170.3	176.8	169	165.9	177	0	108.4	D1015 D1017 L1418 T1419 I1427 N1432	D1015-K1430 IonicContact OD1-NZ 2.78Å; D1015-K1430 PolarHBondContact OD1-NZ 3.13Å; D1015-K1430 IonicContact OD2-NZ 2.66Å; D1015-K1430 PolarHBondContact OD2-NZ 3.36Å; D1017-K1430 WeakPolarHBondContact OD2-CD 3.35Å; D1017-K1430 IonicContact OD2-NZ 2.62Å; D1017-K1430 PolarHBondContact OD2-NZ 3.45Å; L1418-K1430 WeakPolarHBondContact O-CA 3.29Å; T1419-K1430 HydrophobicContact CG2-CB 3.95Å; T1419-K1430 HydrophobicContact CG2-CD 4.02Å; T1419-K1430 HydrophobicContact CG2-CG 3.79Å; I1427-K1430 HydrophobicContact CG2-CB 4.27Å; K1430-N1432 WeakPolarHBondContact CE-OD1 3.32Å
1431	L	86.1	Confident	84.9	Confident	5 Å²	5	52.8 Å²	52.8	3%	0.026	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	121.1	-179	-62.5	171.2	0	0	0	108.1	C1417 L1418 K1429 L1448 F1450 L1463	C1417-L1431 CarbonylContact C-O 3.51Å; C1417-L1431 WeakPolarHBondContact CA-O 3.29Å; C1417-L1431 VanDerWaalsContact CB-O 3.26Å; C1417-L1431 WeakPolarHBondContact CB-O 3.39Å; L1418-L1431 HydrophobicContact CB-CB 4.35Å; L1418-L1431 PolarHBondContact N-O 3.26Å; L1418-L1431 PolarHBondContact O-N 3.39Å; K1429-L1431 HydrophobicContact CG-CD2 4.32Å; K1429-L1431 HydrophobicContact CG-CG 4.4Å; L1431-L1448 HydrophobicContact CD1-CD1 4.35Å; L1431-F1450 HydrophobicContact CD1-CD1 4.28Å; L1431-F1450 HydrophobicContact CD1-CE1 4.45Å; L1431-F1450 HydrophobicContact CD2-CB 4.39Å; L1431-F1450 HydrophobicContact CD2-CD1 3.8Å; L1431-F1450 HydrophobicContact CD2-CD2 3.5Å; L1431-F1450 VanDerWaalsContact CD2-CD2 3.5Å; L1431-F1450 HydrophobicContact CD2-CE1 3.96Å; L1431-F1450 HydrophobicContact CD2-CE2 3.65Å; L1431-F1450 HydrophobicContact CD2-CG 3.6Å; L1431-F1450 HydrophobicContact CD2-CZ 3.9Å; L1431-L1463 HydrophobicContact CD1-CD2 3.89Å
1432	N	85.6	Confident	84.7	Confident	53 Å²	53	59.9 Å²	59.9	28%	0.283	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	147.8	173.3	-61.3	-24.9	0	0	0	109.5	C1417 K1430 D1434 Q1435	C1417-N1432 WeakPolarHBondContact CB-OD1 3.44Å; K1430-N1432 WeakPolarHBondContact CE-OD1 3.32Å; N1432-D1434 PolarHBondContact O-N 3.08Å; N1432-Q1435 HydrophobicContact CB-CG 4.45Å; N1432-Q1435 WeakPolarHBondContact O-CB 3.31Å; N1432-Q1435 PolarHBondContact O-N 3.41Å
1433	Y	83.2	Confident	84.5	Confident	10 Å²	10	65.4 Å²	65.4	4%	0.039	34%	0.335	C	S	.	.	G	3₁₀ helix	trans	-61.4	-32.4	179.7	-66	-46.8	0	0	0	112.6	I1413 Y1414 G1415 K1416 L1418 Q1435 L1436 I1477 L1480 M1481	I1413-Y1433 WeakPolarHBondContact CG2-OH 3.19Å; Y1414-Y1433 WeakPolarHBondContact O-CE2 3.46Å; Y1414-Y1433 PolarHBondContact O-OH 2.82Å; G1415-Y1433 WeakPolarHBondContact O-CE2 2.99Å; K1416-Y1433 WeakPolarHBondContact O-CD2 3.49Å; K1416-Y1433 PolarHBondContact O-N 3.16Å; L1418-Y1433 HydrophobicContact CD1-CE1 4.1Å; L1418-Y1433 HydrophobicContact CD2-CE1 4.06Å; L1418-Y1433 HydrophobicContact CG-CE1 3.74Å; Y1433-Q1435 PolarHBondContact O-N 3.24Å; Y1433-Q1435 VanDerWaalsContact O-N 3.07Å; Y1433-L1436 VanDerWaalsContact O-CB 3.32Å; Y1433-L1436 WeakPolarHBondContact O-CB 3.32Å; Y1433-L1436 PolarHBondContact O-N 3.07Å; Y1433-I1477 HydrophobicContact CD1-CG2 4.36Å; Y1433-I1477 HydrophobicContact CE1-CG2 3.79Å; Y1433-L1480 HydrophobicContact CE2-CB 4.27Å; Y1433-M1481 HydrophobicContact CD1-CG 3.93Å; Y1433-M1481 HydrophobicContact CD1-SD 4.27Å; Y1433-M1481 HydrophobicContact CD2-CG 4.43Å; Y1433-M1481 HydrophobicContact CG-CG 3.93Å
1434	D	81	Confident	84.5	Confident	146 Å²	146	64.9 Å²	64.9	78%	0.781	34%	0.337	S	S	*	.	G	3₁₀ helix	trans	-57.8	-20.6	173.1	-49.4	-11.9	0	0	0	114	N1432	N1432-D1434 PolarHBondContact O-N 3.08Å
1435	Q	82.1	Confident	84.7	Confident	35 Å²	35	65 Å²	65	16%	0.164	33%	0.332	C	S	.	.	G	3₁₀ helix	trans	-93.5	-14.3	177.8	-66.1	168.6	-25.3	0	0	112.2	N1432 Y1433 F1450 N1451	N1432-Q1435 HydrophobicContact CB-CG 4.45Å; N1432-Q1435 WeakPolarHBondContact O-CB 3.31Å; N1432-Q1435 PolarHBondContact O-N 3.41Å; Y1433-Q1435 PolarHBondContact O-N 3.24Å; Y1433-Q1435 VanDerWaalsContact O-N 3.07Å; Q1435-F1450 CarbonylContact O-C 3.49Å; Q1435-F1450 WeakPolarHBondContact O-CA 3.3Å; Q1435-F1450 VanDerWaalsContact O-CB 3.26Å; Q1435-F1450 WeakPolarHBondContact O-CB 3.45Å; Q1435-N1451 PolarHBondContact O-N 3.15Å
1436	L	82.3	Confident	85	Confident	21 Å²	21	65 Å²	65	11%	0.11	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77	126.9	-176.3	-154.3	80.3	0	0	0	110.8	Y1433 L1439 L1448 F1450 I1477 M1481	Y1433-L1436 VanDerWaalsContact O-CB 3.32Å; Y1433-L1436 WeakPolarHBondContact O-CB 3.32Å; Y1433-L1436 PolarHBondContact O-N 3.07Å; L1436-L1439 HydrophobicContact CD2-CB 4.23Å; L1436-L1448 HydrophobicContact CD1-CB 4.25Å; L1436-L1448 HydrophobicContact CD1-CD2 3.67Å; L1436-L1448 HydrophobicContact CD2-CD2 4.33Å; L1436-F1450 HydrophobicContact CD1-CB 4.5Å; L1436-I1477 HydrophobicContact CD2-CG2 4.45Å; L1436-M1481 HydrophobicContact CB-CE 4.28Å; L1436-M1481 HydrophobicContact CD2-CE 4.13Å; L1436-M1481 HydrophobicContact CD2-SD 3.61Å
1437	I	81.9	Confident	85.2	Confident	86 Å²	86	61.1 Å²	61.1	44%	0.441	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	-43.8	-177.7	-56.1	167.5	0	0	0	110.6	N1449 V1460	I1437-N1449 HydrophobicContact CB-CB 4.33Å; I1437-N1449 PolarHBondContact N-O 2.73Å; I1437-V1460 HydrophobicContact CD1-CB 4.28Å; I1437-V1460 HydrophobicContact CD1-CG1 3.76Å; I1437-V1460 HydrophobicContact CD1-CG2 3.69Å
1438	D	82.7	Confident	85.2	Confident	75 Å²	75	58.7 Å²	58.7	40%	0.401	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.1	144	-174	168.8	51.1	0	0	0	110.3	N1449	D1438-N1449 HydrophobicContact CB-CB 4.07Å; D1438-N1449 PolarHBondContact N-O 2.63Å; D1438-N1449 PolarHBondContact O-N 3Å; D1438-N1449 PolarHBondContact OD2-ND2 3.04Å
1439	L	86.2	Confident	85.1	Confident	28 Å²	28	56.6 Å²	56.6	15%	0.147	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	113	-177.1	172.5	63.4	0	0	0	107.5	L1436 I1446 L1448 C1474 I1477 E1478	L1436-L1439 HydrophobicContact CD2-CB 4.23Å; L1439-I1446 HydrophobicContact CD1-CG2 3.78Å; L1439-L1448 HydrophobicContact CD1-CD2 3.61Å; L1439-L1448 HydrophobicContact CD1-CG 4.47Å; L1439-C1474 HydrophobicContact CD2-CB 4.37Å; L1439-I1477 HydrophobicContact CD2-CB 3.88Å; L1439-I1477 HydrophobicContact CD2-CG2 3.67Å; L1439-E1478 HydrophobicContact CD2-CG 3.91Å
1440	S	85.7	Confident	85	Confident	50 Å²	50	53.9 Å²	53.9	35%	0.35	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	154.7	176.7	47.9	0	0	0	0	110.9	S1447	S1440-S1447 PolarHBondContact N-O 3.27Å; S1440-S1447 VanDerWaalsContact N-O 3.09Å; S1440-S1447 PolarHBondContact O-N 2.98Å
1441	F	86.9	Confident	84.6	Confident	88 Å²	88	53.3 Å²	53.3	39%	0.386	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	144.9	170.7	73.3	-85	0	0	0	111.7	I1445 K1471 C1474	F1441-I1445 CarbonylContact C-O 3.5Å; F1441-I1445 WeakPolarHBondContact CA-O 3.44Å; F1441-K1471 HydrophobicContact CE1-CG 4.42Å; F1441-K1471 HydrophobicContact CE2-CB 3.92Å; F1441-K1471 HydrophobicContact CE2-CG 4.17Å; F1441-K1471 HydrophobicContact CZ-CB 4.01Å; F1441-K1471 HydrophobicContact CZ-CD 4.31Å; F1441-K1471 HydrophobicContact CZ-CG 3.79Å; F1441-C1474 HydrophobicContact CD1-CB 3.89Å; F1441-C1474 HydrophobicContact CE1-CB 4.39Å
1442	E	85.4	Confident	83.8	Confident	155 Å²	155	56 Å²	56	72%	0.724	29%	0.294	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-131.3	116.4	174.5	-172.5	174.6	-161.3	0	0	107.7	S1444 I1445	E1442-S1444 PolarHBondContact O-N 3.02Å; E1442-I1445 PolarHBondContact N-O 2.93Å; E1442-I1445 PolarHBondContact O-N 3.37Å
1443	D	83.8	Confident	82.5	Confident	150 Å²	150	60.9 Å²	60.9	80%	0.802	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.6	-101	-169.7	-63.8	-26.1	0	0	0	113.4
1444	S	85.3	Confident	81	Confident	52 Å²	52	67.6 Å²	67.6	36%	0.364	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.3	11.8	-179.4	-50.1	0	0	0	0	113.2	E1442 R1466 C1467	E1442-S1444 PolarHBondContact O-N 3.02Å; S1444-R1466 CarbonylContact O-C 3.47Å; S1444-R1466 VanDerWaalsContact O-CA 3.31Å; S1444-R1466 WeakPolarHBondContact O-CA 3.29Å; S1444-C1467 PolarHBondContact O-N 2.87Å
1445	I	87.5	Confident	79.1	Confident	56 Å²	56	63.8 Å²	63.8	29%	0.287	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	121	-176.9	-58.5	177.3	0	0	0	110	L1401 F1441 E1442 I1465	L1401-I1445 HydrophobicContact CD1-CB 4.4Å; L1401-I1445 HydrophobicContact CD1-CD1 3.96Å; L1401-I1445 HydrophobicContact CD1-CG1 4.01Å; L1401-I1445 HydrophobicContact CD1-CG2 3.58Å; F1441-I1445 CarbonylContact C-O 3.5Å; F1441-I1445 WeakPolarHBondContact CA-O 3.44Å; E1442-I1445 PolarHBondContact N-O 2.93Å; E1442-I1445 PolarHBondContact O-N 3.37Å; I1445-I1465 CarbonylContact C-O 3.53Å; I1445-I1465 WeakPolarHBondContact CA-O 3.5Å
1446	I	89	Confident	77.6	Confident	1 Å²	1	67.5 Å²	67.5	1%	0.005	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	134.3	169.1	-49.5	174.9	0	0	0	108.5	L1439 L1448 R1464 I1465 A1470 I1473	L1439-I1446 HydrophobicContact CD1-CG2 3.78Å; I1446-L1448 HydrophobicContact CG2-CG 4.17Å; I1446-R1464 WeakPolarHBondContact O-CA 3.09Å; I1446-I1465 HydrophobicContact CB-CB 4.4Å; I1446-I1465 PolarHBondContact N-O 2.68Å; I1446-I1465 PolarHBondContact O-N 2.83Å; I1446-A1470 HydrophobicContact CD1-CB 4.34Å; I1446-A1470 HydrophobicContact CG1-CB 3.76Å; I1446-I1473 HydrophobicContact CD1-CB 3.75Å; I1446-I1473 HydrophobicContact CD1-CD1 3.97Å; I1446-I1473 HydrophobicContact CD1-CG1 4.47Å; I1446-I1473 HydrophobicContact CD1-CG2 3.48Å; I1446-I1473 VanDerWaalsContact CD1-CG2 3.48Å
1447	S	88.5	Confident	76.3	Confident	18 Å²	18	75.6 Å²	75.6	13%	0.126	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	118.5	169.4	-66.1	0	0	0	0	109.4	S1440	S1440-S1447 PolarHBondContact N-O 3.27Å; S1440-S1447 VanDerWaalsContact N-O 3.09Å; S1440-S1447 PolarHBondContact O-N 2.98Å
1448	L	85.8	Confident	75.1	Confident	2 Å²	2	77.8 Å²	77.8	1%	0.01	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	110.8	176.8	-67.7	159.2	0	0	0	108.6	L1418 L1431 L1436 L1439 I1446 L1463 I1465	L1418-L1448 HydrophobicContact CD1-CD1 4.4Å; L1418-L1448 HydrophobicContact CD1-CD2 4.11Å; L1431-L1448 HydrophobicContact CD1-CD1 4.35Å; L1436-L1448 HydrophobicContact CD1-CB 4.25Å; L1436-L1448 HydrophobicContact CD1-CD2 3.67Å; L1436-L1448 HydrophobicContact CD2-CD2 4.33Å; L1439-L1448 HydrophobicContact CD1-CD2 3.61Å; L1439-L1448 HydrophobicContact CD1-CG 4.47Å; I1446-L1448 HydrophobicContact CG2-CG 4.17Å; L1448-L1463 HydrophobicContact CB-CB 4.32Å; L1448-L1463 HydrophobicContact CD1-CD2 4.14Å; L1448-L1463 PolarHBondContact N-O 3.38Å; L1448-L1463 PolarHBondContact O-N 2.79Å; L1448-I1465 HydrophobicContact CD1-CD1 3.55Å; L1448-I1465 HydrophobicContact CD1-CG1 4.43Å
1449	N	84.5	Confident	74.4	Confident	38 Å²	38	80.2 Å²	80.2	20%	0.203	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	129.5	170.6	-71.5	-53.2	0	0	0	109.2	I1437 D1438 L1462	I1437-N1449 HydrophobicContact CB-CB 4.33Å; I1437-N1449 PolarHBondContact N-O 2.73Å; D1438-N1449 HydrophobicContact CB-CB 4.07Å; D1438-N1449 PolarHBondContact N-O 2.63Å; D1438-N1449 PolarHBondContact O-N 3Å; D1438-N1449 PolarHBondContact OD2-ND2 3.04Å; N1449-L1462 WeakPolarHBondContact OD1-CD1 3.48Å
1450	F	84.1	Confident	73.8	Confident	5 Å²	5	83 Å²	83	2%	0.022	43%	0.429	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	157.9	-179.3	59.3	-83.8	0	0	0	112.7	K1429 L1431 Q1435 L1436 E1452 V1460 S1461 L1463	K1429-F1450 HydrophobicContact CD-CZ 4.46Å; K1429-F1450 VanDerWaalsContact CE-CZ 3.44Å; L1431-F1450 HydrophobicContact CD1-CD1 4.28Å; L1431-F1450 HydrophobicContact CD1-CE1 4.45Å; L1431-F1450 HydrophobicContact CD2-CB 4.39Å; L1431-F1450 HydrophobicContact CD2-CD1 3.8Å; L1431-F1450 HydrophobicContact CD2-CD2 3.5Å; L1431-F1450 VanDerWaalsContact CD2-CD2 3.5Å; L1431-F1450 HydrophobicContact CD2-CE1 3.96Å; L1431-F1450 HydrophobicContact CD2-CE2 3.65Å; L1431-F1450 HydrophobicContact CD2-CG 3.6Å; L1431-F1450 HydrophobicContact CD2-CZ 3.9Å; Q1435-F1450 CarbonylContact O-C 3.49Å; Q1435-F1450 WeakPolarHBondContact O-CA 3.3Å; Q1435-F1450 VanDerWaalsContact O-CB 3.26Å; Q1435-F1450 WeakPolarHBondContact O-CB 3.45Å; L1436-F1450 HydrophobicContact CD1-CB 4.5Å; F1450-E1452 HydrophobicContact CE2-CB 4.46Å; F1450-V1460 WeakPolarHBondContact O-CA 3.47Å; F1450-S1461 VanDerWaalsContact CD1-O 3.27Å; F1450-S1461 WeakPolarHBondContact CD1-O 3.38Å; F1450-S1461 VanDerWaalsContact CE1-O 3.31Å; F1450-S1461 WeakPolarHBondContact CE1-O 3.12Å; F1450-S1461 VanDerWaalsContact CZ-CB 3.42Å; F1450-S1461 PolarHBondContact N-O 2.91Å; F1450-S1461 PolarHBondContact O-N 3.36Å; F1450-L1463 HydrophobicContact CE1-CB 3.74Å
1451	N	79	Confident	73.6	Confident	45 Å²	45	81.7 Å²	81.7	24%	0.241	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	126.6	172.8	-76.6	-52.6	0	0	0	110.9	Q1435	Q1435-N1451 PolarHBondContact O-N 3.15Å
1452	E	69.6	Low	73.4	Confident	63 Å²	63	81.2 Å²	81.2	29%	0.294	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	107	178.9	-160.9	144.2	-127.1	0	0	110.3	K1429 F1450 Q1454 Q1459 S1461	K1429-E1452 IonicContact NZ-OE1 2.67Å; K1429-E1452 PolarHBondContact NZ-OE1 3.34Å; F1450-E1452 HydrophobicContact CE2-CB 4.46Å; E1452-Q1454 PolarHBondContact O-N 3.27Å; E1452-Q1459 PolarHBondContact N-O 3.27Å; E1452-S1461 WeakPolarHBondContact OE2-CB 3.45Å; E1452-S1461 PolarHBondContact OE2-OG 2.95Å
1453	Q	57.7	Low	73.3	Confident	155 Å²	155	74.4 Å²	74.4	72%	0.724	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.4	17	-164.1	-122	173.2	0.6	0	0	115.6
1454	Q	52.2	Low	73.5	Confident	150 Å²	150	73.5 Å²	73.5	70%	0.701	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.8	-3.8	-165.9	-88.6	-171.1	-8.9	0	0	116.6	N1197 E1452	N1197-Q1454 PolarHBondContact ND2-O 3Å; E1452-Q1454 PolarHBondContact O-N 3.27Å
1455	T	40.6	Very low	73.6	Confident	67 Å²	67	71 Å²	71	41%	0.411	36%	0.357	S	S	.	.	S	Bend	trans	-147.6	171.7	169.3	54	0	0	0	0	111.6	Y1457	T1455-Y1457 PolarHBondContact O-N 3.42Å
1456	S	51.1	Low	73.6	Confident	112 Å²	112	73 Å²	73	78%	0.783	36%	0.361	S	S	*	.	S	Bend	trans	-64.7	9.3	-175.7	-21	0	0	0	0	116.2
1457	Y	54.8	Low	73.5	Confident	192 Å²	192	73.3 Å²	73.3	75%	0.753	36%	0.363	S	S	*	.	S	Bend	trans	-128.6	127.9	173.8	-71.1	-85.6	0	0	0	109.1	T1455 Q1459	T1455-Y1457 PolarHBondContact O-N 3.42Å; Y1457-Q1459 PolarHBondContact O-N 3.5Å
1458	N	58	Low	73.3	Confident	132 Å²	132	79.9 Å²	79.9	71%	0.706	40%	0.397	S	S	*	.			trans	-63.3	99.5	174	-80.6	-1.8	0	0	0	110
1459	Q	66.4	Low	73.2	Confident	126 Å²	126	85.5 Å²	85.5	59%	0.589	42%	0.421	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.5	120.9	174.3	-166.4	164.7	-9	0	0	108.8	E1452 Y1457	E1452-Q1459 PolarHBondContact N-O 3.27Å; Y1457-Q1459 PolarHBondContact O-N 3.5Å
1460	V	74.7	Confident	73.3	Confident	87 Å²	87	83.8 Å²	83.8	53%	0.527	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	120.3	176.6	179	0	0	0	0	108.8	I1437 F1450	I1437-V1460 HydrophobicContact CD1-CB 4.28Å; I1437-V1460 HydrophobicContact CD1-CG1 3.76Å; I1437-V1460 HydrophobicContact CD1-CG2 3.69Å; F1450-V1460 WeakPolarHBondContact O-CA 3.47Å
1461	S	80.7	Confident	73.3	Confident	22 Å²	22	89.8 Å²	89.8	15%	0.154	44%	0.438	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	139.8	177.9	-77	0	0	0	0	110	F1450 E1452	F1450-S1461 VanDerWaalsContact CD1-O 3.27Å; F1450-S1461 WeakPolarHBondContact CD1-O 3.38Å; F1450-S1461 VanDerWaalsContact CE1-O 3.31Å; F1450-S1461 WeakPolarHBondContact CE1-O 3.12Å; F1450-S1461 VanDerWaalsContact CZ-CB 3.42Å; F1450-S1461 PolarHBondContact N-O 2.91Å; F1450-S1461 PolarHBondContact O-N 3.36Å; E1452-S1461 WeakPolarHBondContact OE2-CB 3.45Å; E1452-S1461 PolarHBondContact OE2-OG 2.95Å
1462	L	83.5	Confident	73.6	Confident	77 Å²	77	92 Å²	92	40%	0.403	45%	0.447	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	119.3	-178.6	167.3	62.6	0	0	0	109.3	N1449 R1464	N1449-L1462 WeakPolarHBondContact OD1-CD1 3.48Å; L1462-R1464 HydrophobicContact CD1-CG 4.06Å; L1462-R1464 HydrophobicContact CD2-CG 4.34Å; L1462-R1464 HydrophobicContact CG-CG 4.15Å
1463	L	83.8	Confident	74.4	Confident	12 Å²	12	89 Å²	89	6%	0.063	43%	0.433	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	119.7	170.3	177.1	65.2	0	0	0	108.9	I1400 V1420 L1431 L1448 F1450 I1465	I1400-L1463 HydrophobicContact CG2-CD1 3.76Å; V1420-L1463 HydrophobicContact CG2-CD2 4.46Å; L1431-L1463 HydrophobicContact CD1-CD2 3.89Å; L1448-L1463 HydrophobicContact CB-CB 4.32Å; L1448-L1463 HydrophobicContact CD1-CD2 4.14Å; L1448-L1463 PolarHBondContact N-O 3.38Å; L1448-L1463 PolarHBondContact O-N 2.79Å; F1450-L1463 HydrophobicContact CE1-CB 3.74Å; L1463-I1465 HydrophobicContact CD1-CG1 4.45Å; L1463-I1465 HydrophobicContact CD2-CD1 3.89Å; L1463-I1465 HydrophobicContact CD2-CG1 4.2Å; L1463-I1465 HydrophobicContact CG-CD1 4.12Å; L1463-I1465 HydrophobicContact CG-CG1 3.87Å
1464	R	86	Confident	75.7	Confident	131 Å²	131	81.7 Å²	81.7	49%	0.494	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	129.2	173.5	-76.1	-171.9	173	157.3	1.1	110.6	L1401 I1446 L1462	L1401-R1464 HydrophobicContact CB-CB 3.94Å; L1401-R1464 HydrophobicContact CD1-CB 3.93Å; L1401-R1464 PolarHBondContact N-O 2.94Å; I1446-R1464 WeakPolarHBondContact O-CA 3.09Å; L1462-R1464 HydrophobicContact CD1-CG 4.06Å; L1462-R1464 HydrophobicContact CD2-CG 4.34Å; L1462-R1464 HydrophobicContact CG-CG 4.15Å
1465	I	88.2	Confident	77.3	Confident	1 Å²	1	79.6 Å²	79.6	1%	0.005	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	128.1	-172.6	-55.3	-178.1	0	0	0	108.7	I1398 E1399 I1445 I1446 L1448 L1463	I1398-I1465 HydrophobicContact CB-CG2 3.46Å; I1398-I1465 VanDerWaalsContact CB-CG2 3.46Å; I1398-I1465 HydrophobicContact CD1-CD1 4.19Å; I1398-I1465 HydrophobicContact CD1-CG2 3.68Å; I1398-I1465 HydrophobicContact CG1-CG2 4.19Å; I1398-I1465 HydrophobicContact CG2-CG2 3.65Å; E1399-I1465 CarbonylContact O-C 3.55Å; E1399-I1465 WeakPolarHBondContact O-CA 3.44Å; I1445-I1465 CarbonylContact C-O 3.53Å; I1445-I1465 WeakPolarHBondContact CA-O 3.5Å; I1446-I1465 HydrophobicContact CB-CB 4.4Å; I1446-I1465 PolarHBondContact N-O 2.68Å; I1446-I1465 PolarHBondContact O-N 2.83Å; L1448-I1465 HydrophobicContact CD1-CD1 3.55Å; L1448-I1465 HydrophobicContact CD1-CG1 4.43Å; L1463-I1465 HydrophobicContact CD1-CG1 4.45Å; L1463-I1465 HydrophobicContact CD2-CD1 3.89Å; L1463-I1465 HydrophobicContact CD2-CG1 4.2Å; L1463-I1465 HydrophobicContact CG-CD1 4.12Å; L1463-I1465 HydrophobicContact CG-CG1 3.87Å
1466	R	87.4	Confident	79.4	Confident	97 Å²	97	77.6 Å²	77.6	37%	0.366	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	133.3	167.6	-176.6	-175	-66.2	137.2	0.7	109.8	I1398 E1399 L1401 S1444	I1398-R1466 WeakPolarHBondContact CA-O 3.15Å; E1399-R1466 HydrophobicContact CB-CB 4.27Å; E1399-R1466 PolarHBondContact N-O 3.49Å; E1399-R1466 PolarHBondContact O-N 2.84Å; E1399-R1466 IonicContact OE1-CZ 3.99Å; E1399-R1466 IonicContact OE1-NH1 2.86Å; E1399-R1466 PolarHBondContact OE1-NH1 3.32Å; E1399-R1466 WeakPolarHBondContact OE2-CD 3.44Å; E1399-R1466 IonicContact OE2-CZ 3.61Å; E1399-R1466 IonicContact OE2-NE 3.91Å; E1399-R1466 IonicContact OE2-NH1 2.65Å; E1399-R1466 PolarHBondContact OE2-NH1 2.89Å; L1401-R1466 HydrophobicContact CD1-CB 4.29Å; L1401-R1466 HydrophobicContact CD2-CB 4.49Å; L1401-R1466 HydrophobicContact CG-CB 4.39Å; S1444-R1466 CarbonylContact O-C 3.47Å; S1444-R1466 VanDerWaalsContact O-CA 3.31Å; S1444-R1466 WeakPolarHBondContact O-CA 3.29Å
1467	C	86.9	Confident	81	Confident	8 Å²	8	72.3 Å²	72.3	5%	0.054	34%	0.34	C	S	.	.			trans	-156.6	137.7	175.7	-170.4	0	0	0	0	111.5	E1397 I1398 S1444 K1469 A1470 I1473	E1397-C1467 PolarHBondContact O-SG 2.95Å; I1398-C1467 HydrophobicContact CG2-CB 3.98Å; S1444-C1467 PolarHBondContact O-N 2.87Å; C1467-K1469 PolarHBondContact O-N 3.08Å; C1467-A1470 WeakPolarHBondContact O-CB 3.32Å; C1467-A1470 PolarHBondContact O-N 3.1Å; C1467-I1473 HydrophobicContact CB-CD1 3.99Å; C1467-I1473 WeakPolarHBondContact SG-CD1 3.33Å
1468	D	83.5	Confident	82.5	Confident	156 Å²	156	66.4 Å²	66.4	83%	0.834	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.4	-27	176.5	-61.8	-18.6	0	0	0	113
1469	K	85.2	Confident	83.7	Confident	120 Å²	120	68.3 Å²	68.3	52%	0.522	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.5	25.6	-177.5	-63.8	-176.8	177.5	-178.3	0	113	Y1396 C1467 K1471 Q1472 I1473	Y1396-K1469 HydrophobicContact CD1-CB 4.16Å; Y1396-K1469 HydrophobicContact CD1-CD 4.17Å; Y1396-K1469 HydrophobicContact CE1-CB 3.84Å; Y1396-K1469 HydrophobicContact CE1-CD 3.69Å; Y1396-K1469 HydrophobicContact CE1-CG 4.38Å; C1467-K1469 PolarHBondContact O-N 3.08Å; K1469-K1471 VanDerWaalsContact C-N 3.35Å; K1469-K1471 PolarHBondContact O-N 2.69Å; K1469-Q1472 HydrophobicContact CB-CB 4.43Å; K1469-Q1472 WeakPolarHBondContact O-CB 3.06Å; K1469-Q1472 PolarHBondContact O-N 3.07Å; K1469-I1473 PolarHBondContact O-N 3.29Å
1470	A	85.1	Confident	84.4	Confident	2 Å²	2	62.9 Å²	62.9	2%	0.017	29%	0.292	C	S	.	.	H	α-helix	trans	-45.9	-50.5	-175.6	0	0	0	0	0	114.2	I1446 C1467 Q1472 I1473 C1474	I1446-A1470 HydrophobicContact CD1-CB 4.34Å; I1446-A1470 HydrophobicContact CG1-CB 3.76Å; C1467-A1470 WeakPolarHBondContact O-CB 3.32Å; C1467-A1470 PolarHBondContact O-N 3.1Å; A1470-Q1472 VanDerWaalsContact C-N 3.33Å; A1470-Q1472 PolarHBondContact O-N 2.96Å; A1470-I1473 PolarHBondContact O-N 2.6Å; A1470-C1474 PolarHBondContact O-N 3.3Å
1471	K	85.3	Confident	84.7	Confident	130 Å²	130	61 Å²	61	57%	0.565	28%	0.278	S	S	*	.	H	α-helix	trans	-59.7	-39.1	178.1	-177.2	178	179.3	-175.7	0	113.4	F1441 K1469 H1475	F1441-K1471 HydrophobicContact CE1-CG 4.42Å; F1441-K1471 HydrophobicContact CE2-CB 3.92Å; F1441-K1471 HydrophobicContact CE2-CG 4.17Å; F1441-K1471 HydrophobicContact CZ-CB 4.01Å; F1441-K1471 HydrophobicContact CZ-CD 4.31Å; F1441-K1471 HydrophobicContact CZ-CG 3.79Å; K1469-K1471 VanDerWaalsContact C-N 3.35Å; K1469-K1471 PolarHBondContact O-N 2.69Å; K1471-H1475 PolarHBondContact O-N 3.29Å
1472	Q	85	Confident	84.6	Confident	92 Å²	92	66 Å²	66	43%	0.43	30%	0.299	S	S	.	.	H	α-helix	trans	-69	-43.5	179.2	-168.9	-179.4	29.2	0	0	110.5	Y1396 K1469 A1470 C1474 H1475 T1476	Y1396-Q1472 VanDerWaalsContact OH-CD 3.31Å; Y1396-Q1472 PolarHBondContact OH-OE1 3.14Å; Y1396-Q1472 VanDerWaalsContact OH-OE1 3.06Å; K1469-Q1472 HydrophobicContact CB-CB 4.43Å; K1469-Q1472 WeakPolarHBondContact O-CB 3.06Å; K1469-Q1472 PolarHBondContact O-N 3.07Å; A1470-Q1472 VanDerWaalsContact C-N 3.33Å; A1470-Q1472 PolarHBondContact O-N 2.96Å; Q1472-C1474 PolarHBondContact O-N 3.01Å; Q1472-H1475 PolarHBondContact O-N 2.78Å; Q1472-T1476 PolarHBondContact O-N 2.9Å; Q1472-T1476 PolarHBondContact O-OG1 2.93Å; Q1472-T1476 VanDerWaalsContact O-OG1 3.13Å
1473	I	85.5	Confident	84.1	Confident	0 Å²	0	67.8 Å²	67.8	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-58.6	-49	176.7	-68	165.5	0	0	0	110.7	Y1396 L1411 I1413 I1446 C1467 K1469 A1470 H1475 T1476 I1477	Y1396-I1473 HydrophobicContact CD1-CD1 4.01Å; Y1396-I1473 HydrophobicContact CD1-CG1 4.12Å; Y1396-I1473 HydrophobicContact CD2-CD1 3.89Å; Y1396-I1473 HydrophobicContact CD2-CG1 3.59Å; Y1396-I1473 HydrophobicContact CE1-CD1 4.45Å; Y1396-I1473 HydrophobicContact CE1-CG1 4.11Å; Y1396-I1473 HydrophobicContact CE2-CD1 4.34Å; Y1396-I1473 HydrophobicContact CE2-CG1 3.56Å; Y1396-I1473 HydrophobicContact CG-CD1 3.69Å; Y1396-I1473 HydrophobicContact CG-CG1 3.86Å; L1411-I1473 HydrophobicContact CD2-CD1 4.43Å; L1411-I1473 HydrophobicContact CD2-CG2 3.95Å; I1413-I1473 HydrophobicContact CD1-CG1 4.46Å; I1413-I1473 HydrophobicContact CD1-CG2 3.98Å; I1446-I1473 HydrophobicContact CD1-CB 3.75Å; I1446-I1473 HydrophobicContact CD1-CD1 3.97Å; I1446-I1473 HydrophobicContact CD1-CG1 4.47Å; I1446-I1473 HydrophobicContact CD1-CG2 3.48Å; I1446-I1473 VanDerWaalsContact CD1-CG2 3.48Å; C1467-I1473 HydrophobicContact CB-CD1 3.99Å; C1467-I1473 WeakPolarHBondContact SG-CD1 3.33Å; K1469-I1473 PolarHBondContact O-N 3.29Å; A1470-I1473 PolarHBondContact O-N 2.6Å; I1473-H1475 PolarHBondContact O-N 3.44Å; I1473-T1476 PolarHBondContact O-N 3.4Å; I1473-I1477 HydrophobicContact CG2-CD1 3.67Å; I1473-I1477 HydrophobicContact CG2-CG1 4.42Å; I1473-I1477 WeakPolarHBondContact O-CG1 3.45Å; I1473-I1477 PolarHBondContact O-N 2.78Å
1474	C	85.3	Confident	83.3	Confident	1 Å²	1	68.3 Å²	68.3	1%	0.007	31%	0.305	C	S	.	.	H	α-helix	trans	-58.9	-49	178.5	-71.2	0	0	0	0	112.1	L1439 F1441 A1470 Q1472 T1476 I1477 E1478	L1439-C1474 HydrophobicContact CD2-CB 4.37Å; F1441-C1474 HydrophobicContact CD1-CB 3.89Å; F1441-C1474 HydrophobicContact CE1-CB 4.39Å; A1470-C1474 PolarHBondContact O-N 3.3Å; Q1472-C1474 PolarHBondContact O-N 3.01Å; C1474-T1476 VanDerWaalsContact C-N 3.33Å; C1474-T1476 PolarHBondContact O-N 2.96Å; C1474-I1477 PolarHBondContact O-N 2.76Å; C1474-I1477 VanDerWaalsContact O-N 3.15Å; C1474-E1478 WeakPolarHBondContact O-CB 3.5Å; C1474-E1478 VanDerWaalsContact O-CG 3.26Å; C1474-E1478 WeakPolarHBondContact O-CG 3.36Å; C1474-E1478 PolarHBondContact O-N 2.9Å
1475	H	86.2	Confident	82.4	Confident	106 Å²	106	66.6 Å²	66.6	49%	0.491	31%	0.305	S	S	.	.	H	α-helix	trans	-62.1	-35.7	176.3	-84.9	1.9	0	0	0	113.7	K1471 Q1472 I1473 E1478 R1479	K1471-H1475 PolarHBondContact O-N 3.29Å; Q1472-H1475 PolarHBondContact O-N 2.78Å; I1473-H1475 PolarHBondContact O-N 3.44Å; H1475-E1478 WeakPolarHBondContact CA-OE2 3.03Å; H1475-E1478 IonicContact CE1-OE2 3.6Å; H1475-E1478 IonicContact CG-OE2 3.79Å; H1475-E1478 IonicContact ND1-OE2 2.77Å; H1475-E1478 PolarHBondContact ND1-OE2 3.24Å; H1475-R1479 WeakPolarHBondContact O-CB 3.13Å; H1475-R1479 PolarHBondContact O-N 3.33Å
1476	T	84.3	Confident	81.1	Confident	26 Å²	26	70.5 Å²	70.5	16%	0.16	33%	0.329	C	S	.	.	H	α-helix	trans	-63.3	-45.6	173.4	-62.7	0	0	0	0	110.5	Q1394 I1413 Q1472 I1473 C1474 R1479 L1480	Q1394-T1476 PolarHBondContact OE1-OG1 2.72Å; I1413-T1476 HydrophobicContact CD1-CG2 4.31Å; I1413-T1476 HydrophobicContact CG2-CG2 4.21Å; Q1472-T1476 PolarHBondContact O-N 2.9Å; Q1472-T1476 PolarHBondContact O-OG1 2.93Å; Q1472-T1476 VanDerWaalsContact O-OG1 3.13Å; I1473-T1476 PolarHBondContact O-N 3.4Å; C1474-T1476 VanDerWaalsContact C-N 3.33Å; C1474-T1476 PolarHBondContact O-N 2.96Å; T1476-R1479 PolarHBondContact O-N 3.42Å; T1476-L1480 HydrophobicContact CG2-CD1 4.05Å; T1476-L1480 VanDerWaalsContact O-CG 3.25Å; T1476-L1480 WeakPolarHBondContact O-CG 3.31Å; T1476-L1480 PolarHBondContact O-N 3.46Å
1477	I	85.5	Confident	79.6	Confident	1 Å²	1	70.1 Å²	70.1	1%	0.005	33%	0.331	C	S	.	.	H	α-helix	trans	-64.9	-48.8	178.9	-65	167.7	0	0	0	111.3	I1413 L1418 Y1433 L1436 L1439 I1473 C1474 R1479 L1480 M1481	I1413-I1477 HydrophobicContact CD1-CG1 4.42Å; I1413-I1477 HydrophobicContact CG2-CG1 4.41Å; L1418-I1477 HydrophobicContact CD1-CD1 3.96Å; L1418-I1477 HydrophobicContact CD2-CD1 3.89Å; L1418-I1477 HydrophobicContact CD2-CG1 4.01Å; Y1433-I1477 HydrophobicContact CD1-CG2 4.36Å; Y1433-I1477 HydrophobicContact CE1-CG2 3.79Å; L1436-I1477 HydrophobicContact CD2-CG2 4.45Å; L1439-I1477 HydrophobicContact CD2-CB 3.88Å; L1439-I1477 HydrophobicContact CD2-CG2 3.67Å; I1473-I1477 HydrophobicContact CG2-CD1 3.67Å; I1473-I1477 HydrophobicContact CG2-CG1 4.42Å; I1473-I1477 WeakPolarHBondContact O-CG1 3.45Å; I1473-I1477 PolarHBondContact O-N 2.78Å; C1474-I1477 PolarHBondContact O-N 2.76Å; C1474-I1477 VanDerWaalsContact O-N 3.15Å; I1477-R1479 VanDerWaalsContact C-N 3.31Å; I1477-R1479 PolarHBondContact O-N 3.22Å; I1477-L1480 PolarHBondContact O-N 3.21Å; I1477-L1480 VanDerWaalsContact O-N 3.08Å; I1477-M1481 HydrophobicContact CG2-CG 4.3Å; I1477-M1481 HydrophobicContact CG2-SD 3.98Å; I1477-M1481 WeakPolarHBondContact O-CG 3.43Å; I1477-M1481 PolarHBondContact O-N 2.97Å
1478	E	86	Confident	78.3	Confident	68 Å²	68	74.4 Å²	74.4	32%	0.318	35%	0.354	S	S	.	.	H	α-helix	trans	-55.1	-46	177.3	-71.2	166.8	159.3	0	0	111.5	L1439 C1474 H1475 L1480 M1481 Q1482	L1439-E1478 HydrophobicContact CD2-CG 3.91Å; C1474-E1478 WeakPolarHBondContact O-CB 3.5Å; C1474-E1478 VanDerWaalsContact O-CG 3.26Å; C1474-E1478 WeakPolarHBondContact O-CG 3.36Å; C1474-E1478 PolarHBondContact O-N 2.9Å; H1475-E1478 WeakPolarHBondContact CA-OE2 3.03Å; H1475-E1478 IonicContact CE1-OE2 3.6Å; H1475-E1478 IonicContact CG-OE2 3.79Å; H1475-E1478 IonicContact ND1-OE2 2.77Å; H1475-E1478 PolarHBondContact ND1-OE2 3.24Å; E1478-L1480 VanDerWaalsContact C-N 3.33Å; E1478-L1480 PolarHBondContact O-N 3.13Å; E1478-M1481 PolarHBondContact O-N 3.47Å; E1478-Q1482 WeakPolarHBondContact O-CB 3.41Å; E1478-Q1482 VanDerWaalsContact O-CG 3.24Å; E1478-Q1482 WeakPolarHBondContact O-CG 3.46Å; E1478-Q1482 PolarHBondContact O-N 3.32Å
1479	R	83.4	Confident	76.9	Confident	171 Å²	171	72.3 Å²	72.3	65%	0.645	35%	0.35	S	S	*	.	H	α-helix	trans	-65.7	-33.9	178.1	-178.1	-178.1	-78.3	179.9	-8.3	112.3	H1475 T1476 I1477 R1483	H1475-R1479 WeakPolarHBondContact O-CB 3.13Å; H1475-R1479 PolarHBondContact O-N 3.33Å; T1476-R1479 PolarHBondContact O-N 3.42Å; I1477-R1479 VanDerWaalsContact C-N 3.31Å; I1477-R1479 PolarHBondContact O-N 3.22Å; R1479-R1483 WeakPolarHBondContact O-CB 3.42Å; R1479-R1483 PolarHBondContact O-N 2.94Å
1480	L	80.9	Confident	75	Confident	12 Å²	12	74.1 Å²	74.1	6%	0.063	36%	0.36	C	S	.	.	H	α-helix	trans	-72.6	-45.2	176.2	-70.8	172.2	0	0	0	111.7	F1393 I1413 Y1433 T1476 I1477 E1478 Q1482 R1483 S1484	F1393-L1480 HydrophobicContact CD1-CD2 4.22Å; F1393-L1480 HydrophobicContact CD2-CD1 3.88Å; F1393-L1480 HydrophobicContact CD2-CD2 3.97Å; F1393-L1480 HydrophobicContact CE1-CD2 3.8Å; F1393-L1480 HydrophobicContact CE2-CD1 4.23Å; F1393-L1480 HydrophobicContact CE2-CD2 3.53Å; F1393-L1480 HydrophobicContact CG-CD1 4.15Å; F1393-L1480 HydrophobicContact CG-CD2 4.3Å; F1393-L1480 HydrophobicContact CZ-CD2 3.43Å; F1393-L1480 VanDerWaalsContact CZ-CD2 3.43Å; I1413-L1480 HydrophobicContact CG2-CD1 3.6Å; Y1433-L1480 HydrophobicContact CE2-CB 4.27Å; T1476-L1480 HydrophobicContact CG2-CD1 4.05Å; T1476-L1480 VanDerWaalsContact O-CG 3.25Å; T1476-L1480 WeakPolarHBondContact O-CG 3.31Å; T1476-L1480 PolarHBondContact O-N 3.46Å; I1477-L1480 PolarHBondContact O-N 3.21Å; I1477-L1480 VanDerWaalsContact O-N 3.08Å; E1478-L1480 VanDerWaalsContact C-N 3.33Å; E1478-L1480 PolarHBondContact O-N 3.13Å; L1480-Q1482 PolarHBondContact O-N 3.48Å; L1480-R1483 WeakPolarHBondContact O-CB 3.48Å; L1480-R1483 PolarHBondContact O-N 2.88Å; L1480-S1484 PolarHBondContact O-N 3.45Å; L1480-S1484 PolarHBondContact O-OG 3.43Å
1481	M	80.4	Confident	72.7	Confident	48 Å²	48	84.2 Å²	84.2	24%	0.236	41%	0.407	C	S	.	.	H	α-helix	trans	-59.4	-46.4	176.5	-69.6	-178.3	71.7	0	0	111.8	Y1433 L1436 I1477 E1478 R1483 S1484 D1485	Y1433-M1481 HydrophobicContact CD1-CG 3.93Å; Y1433-M1481 HydrophobicContact CD1-SD 4.27Å; Y1433-M1481 HydrophobicContact CD2-CG 4.43Å; Y1433-M1481 HydrophobicContact CG-CG 3.93Å; L1436-M1481 HydrophobicContact CB-CE 4.28Å; L1436-M1481 HydrophobicContact CD2-CE 4.13Å; L1436-M1481 HydrophobicContact CD2-SD 3.61Å; I1477-M1481 HydrophobicContact CG2-CG 4.3Å; I1477-M1481 HydrophobicContact CG2-SD 3.98Å; I1477-M1481 WeakPolarHBondContact O-CG 3.43Å; I1477-M1481 PolarHBondContact O-N 2.97Å; E1478-M1481 PolarHBondContact O-N 3.47Å; M1481-R1483 PolarHBondContact O-N 3.17Å; M1481-S1484 WeakPolarHBondContact CA-OG 3.48Å; M1481-S1484 PolarHBondContact O-N 3.24Å; M1481-S1484 PolarHBondContact O-OG 2.79Å; M1481-D1485 PolarHBondContact O-N 3.09Å
1482	Q	80.1	Confident	72.1	Confident	128 Å²	128	82 Å²	82	60%	0.598	40%	0.399	S	S	*	.	H	α-helix	trans	-57.8	-35.2	174.1	-72.9	169.4	17.9	0	0	112.5	E1478 L1480 V1486	E1478-Q1482 WeakPolarHBondContact O-CB 3.41Å; E1478-Q1482 VanDerWaalsContact O-CG 3.24Å; E1478-Q1482 WeakPolarHBondContact O-CG 3.46Å; E1478-Q1482 PolarHBondContact O-N 3.32Å; L1480-Q1482 PolarHBondContact O-N 3.48Å; Q1482-V1486 VanDerWaalsContact O-CG2 3.32Å; Q1482-V1486 WeakPolarHBondContact O-CG2 3.43Å; Q1482-V1486 PolarHBondContact O-N 3.26Å
1483	R	72.9	Confident	71.4	Confident	114 Å²	114	81.4 Å²	81.4	43%	0.43	40%	0.398	S	S	.	.	H	α-helix	trans	-73.5	-41.3	179.2	-163.3	173.1	-173.8	160.8	3.1	111.6	R1479 L1480 M1481 V1486 E1487	R1479-R1483 WeakPolarHBondContact O-CB 3.42Å; R1479-R1483 PolarHBondContact O-N 2.94Å; L1480-R1483 WeakPolarHBondContact O-CB 3.48Å; L1480-R1483 PolarHBondContact O-N 2.88Å; M1481-R1483 PolarHBondContact O-N 3.17Å; R1483-V1486 PolarHBondContact O-N 2.88Å; R1483-E1487 WeakPolarHBondContact O-CG 3.49Å; R1483-E1487 PolarHBondContact O-N 3.31Å
1484	S	66.9	Low	70.6	Confident	23 Å²	23	85.9 Å²	85.9	16%	0.161	42%	0.42	C	S	.	.	H	α-helix	trans	-66	-36.2	174.1	46.6	0	0	0	0	112.9	L1480 M1481 E1487 N1488	L1480-S1484 PolarHBondContact O-N 3.45Å; L1480-S1484 PolarHBondContact O-OG 3.43Å; M1481-S1484 WeakPolarHBondContact CA-OG 3.48Å; M1481-S1484 PolarHBondContact O-N 3.24Å; M1481-S1484 PolarHBondContact O-OG 2.79Å; S1484-E1487 PolarHBondContact O-N 2.87Å; S1484-N1488 WeakPolarHBondContact O-CB 3.45Å; S1484-N1488 PolarHBondContact O-N 2.99Å; S1484-N1488 PolarHBondContact O-ND2 2.99Å
1485	D	65.6	Low	69.8	Low	95 Å²	95	90.9 Å²	90.9	51%	0.508	44%	0.444	S	S	.	.	H	α-helix	trans	-64.8	-40.5	176	-71.5	-21.8	0	0	0	111.6	M1481 C1489	M1481-D1485 PolarHBondContact O-N 3.09Å; D1485-C1489 WeakPolarHBondContact O-CB 3.22Å; D1485-C1489 PolarHBondContact O-N 3.19Å; D1485-C1489 PolarHBondContact O-SG 3.09Å
1486	V	61.4	Low	68.7	Low	82 Å²	82	90 Å²	90	50%	0.497	44%	0.441	S	S	.	.	H	α-helix	trans	-66.5	-41.5	175.1	171.2	0	0	0	0	111.6	Q1482 R1483 C1489 Q1490	Q1482-V1486 VanDerWaalsContact O-CG2 3.32Å; Q1482-V1486 WeakPolarHBondContact O-CG2 3.43Å; Q1482-V1486 PolarHBondContact O-N 3.26Å; R1483-V1486 PolarHBondContact O-N 2.88Å; V1486-C1489 PolarHBondContact O-N 3.21Å; V1486-Q1490 WeakPolarHBondContact O-CG 3.25Å; V1486-Q1490 PolarHBondContact O-N 3.01Å
1487	E	57.3	Low	67.7	Low	89 Å²	89	94.3 Å²	94.3	42%	0.416	46%	0.46	S	S	.	.	H	α-helix	trans	-66.7	-39.8	176.7	-73.3	179.5	-168.5	0	0	112	R1483 S1484 C1489 Q1490 Q1491	R1483-E1487 WeakPolarHBondContact O-CG 3.49Å; R1483-E1487 PolarHBondContact O-N 3.31Å; S1484-E1487 PolarHBondContact O-N 2.87Å; E1487-C1489 VanDerWaalsContact C-N 3.32Å; E1487-C1489 PolarHBondContact O-N 2.63Å; E1487-Q1490 PolarHBondContact O-N 3.25Å; E1487-Q1491 PolarHBondContact O-N 2.77Å
1488	N	57.8	Low	66.4	Low	99 Å²	99	100.9 Å²	100.9	53%	0.529	49%	0.492	S	S	.	.	H	α-helix	trans	-69	-26.6	174.6	-76.5	-21.7	0	0	0	113.2	S1484 Q1490	S1484-N1488 WeakPolarHBondContact O-CB 3.45Å; S1484-N1488 PolarHBondContact O-N 2.99Å; S1484-N1488 PolarHBondContact O-ND2 2.99Å; N1488-Q1490 VanDerWaalsContact C-N 3.32Å
1489	C	54.8	Low	64.9	Low	111 Å²	111	103.5 Å²	103.5	75%	0.75	51%	0.506	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.8	-8.1	173.6	-69.1	0	0	0	0	113.7	D1485 V1486 E1487	D1485-C1489 WeakPolarHBondContact O-CB 3.22Å; D1485-C1489 PolarHBondContact O-N 3.19Å; D1485-C1489 PolarHBondContact O-SG 3.09Å; V1486-C1489 PolarHBondContact O-N 3.21Å; E1487-C1489 VanDerWaalsContact C-N 3.32Å; E1487-C1489 PolarHBondContact O-N 2.63Å
1490	Q	44.8	Very low	63.4	Low	158 Å²	158	97.8 Å²	97.8	74%	0.738	49%	0.494	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.2	-8.6	177.7	-74.2	-177.9	8.6	0	0	113.8	V1486 E1487 N1488	V1486-Q1490 WeakPolarHBondContact O-CG 3.25Å; V1486-Q1490 PolarHBondContact O-N 3.01Å; E1487-Q1490 PolarHBondContact O-N 3.25Å; N1488-Q1490 VanDerWaalsContact C-N 3.32Å
1491	Q	38	Very low	61.8	Low	215 Å²	215	105.6 Å²	105.6	100%	1.005	53%	0.534	S	S	*	.			trans	-92.6	0	172.8	-68.9	-175.2	21.5	0	0	111.9	E1487	E1487-Q1491 PolarHBondContact O-N 2.77Å

Retrieved 1,491 of 1,491 residues in 1486.9 ms (Link to these results)

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